#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oyy n ALA 2 N 0.00 -0.45 -2.77 3.04 0.00 -1.21 -4.74 120.51 114.38 1oyy n ALA 2 Ca 0.00 0.14 -0.35 0.00 0.00 0.00 0.00 53.44 53.23 1oyy n ALA 2 Cb 0.00 -2.18 -0.09 0.00 0.00 0.00 0.00 19.45 17.18 1oyy n ALA 2 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1oyy s GLN 3 N -5.25 4.10 0.17 0.00 -0.21 -1.26 -1.09 119.66 116.11 1oyy s GLN 3 Ca 0.18 -0.27 -0.34 0.00 0.02 0.00 0.00 55.36 54.96 1oyy s GLN 3 Cb -0.08 -3.34 -0.14 0.00 1.00 0.00 0.00 33.01 30.46 1oyy s GLN 3 CO 0.22 0.30 1.60 0.00 -2.12 0.00 0.00 175.29 175.29 1oyy n ALA 4 N 3.49 1.61 0.08 6.09 0.00 -1.14 -4.77 120.51 125.88 1oyy n ALA 4 Ca -0.16 0.44 -0.10 0.00 0.00 0.00 0.00 53.44 53.61 1oyy n ALA 4 Cb 0.52 -2.38 -0.06 0.00 0.00 0.00 0.00 19.45 17.53 1oyy n ALA 4 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1oyy h GLU 5 N 6.10 0.18 -6.06 0.00 5.08 -1.66 -3.47 114.58 114.75 1oyy h GLU 5 Ca -0.45 -0.24 -0.57 0.00 -1.00 0.00 0.00 59.36 57.10 1oyy h GLU 5 Cb 1.24 0.08 -0.10 0.00 0.50 0.00 0.00 28.75 30.48 1oyy h GLU 5 CO 0.90 1.03 -0.60 0.08 -1.00 0.00 0.00 179.01 179.43 1oyy s VAL 6 N -2.97 2.84 -0.21 3.13 1.01 -1.26 -5.07 120.40 117.86 1oyy s VAL 6 Ca -0.02 -1.88 -0.21 0.00 0.00 0.00 0.00 61.98 59.87 1oyy s VAL 6 Cb 0.09 -2.85 -0.18 0.00 0.00 0.00 0.00 36.38 33.44 1oyy s VAL 6 CO 0.84 -0.22 0.15 -0.11 0.00 0.00 0.00 175.10 175.76 1oyy n LEU 7 N -1.01 1.87 -4.42 3.92 0.00 -1.26 -4.77 117.00 111.32 1oyy n LEU 7 Ca -0.04 0.42 -0.44 0.00 0.00 0.00 0.00 56.01 55.95 1oyy n LEU 7 Cb 0.62 -0.95 -0.07 0.00 0.00 0.00 0.00 43.42 43.02 1oyy n LEU 7 CO 0.43 0.29 0.20 0.21 0.00 0.00 0.00 177.39 178.51 1oyy s ASN 8 N -6.89 6.19 0.27 1.96 2.47 -1.26 -4.97 114.94 112.71 1oyy s ASN 8 Ca -0.29 -1.08 -0.01 0.00 0.42 0.00 0.00 52.86 51.90 1oyy s ASN 8 Cb 0.07 -2.24 0.48 0.00 -1.45 0.00 0.00 41.25 38.10 1oyy s ASN 8 CO 0.57 -0.77 1.84 -0.07 -3.72 0.00 0.00 177.10 174.95 1oyy h LEU 9 N 9.28 0.88 0.53 3.21 3.38 -1.96 0.11 115.31 130.73 1oyy h LEU 9 Ca -0.28 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.72 1oyy h LEU 9 Cb 1.10 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 1oyy h LEU 9 CO 0.92 0.50 -0.49 -0.08 0.09 0.00 0.00 178.44 179.38 1oyy h GLU 10 N 0.98 -0.98 0.00 1.13 4.57 -2.00 -2.49 114.58 115.79 1oyy h GLU 10 Ca 0.46 0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.70 1oyy h GLU 10 Cb 0.38 0.22 0.00 0.00 -0.16 0.00 0.00 28.75 29.20 1oyy h GLU 10 CO -0.24 -0.65 0.00 -1.13 -1.18 0.00 0.00 179.01 175.81 1oyy n SER 11 N -5.57 0.57 -0.12 1.04 3.41 -1.06 -3.57 113.62 108.33 1oyy n SER 11 Ca -0.12 0.58 -0.08 0.00 -0.26 0.00 0.00 58.87 58.99 1oyy n SER 11 Cb 0.46 -0.72 0.01 0.00 -0.26 0.00 0.00 64.21 63.69 1oyy n SER 11 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1oyy h GLY 12 N 3.91 0.53 -0.17 5.00 0.00 -0.34 -1.63 103.07 110.37 1oyy h GLY 12 Ca 0.00 -0.17 0.03 0.00 0.00 0.00 0.00 47.33 47.19 1oyy h GLY 12 CO 0.00 0.15 -0.45 0.00 0.00 0.00 0.00 176.54 176.24 1oyy h ALA 13 N 1.16 -0.79 -0.18 3.60 0.00 -1.56 -0.28 119.26 121.22 1oyy h ALA 13 Ca 0.15 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 1oyy h ALA 13 Cb -0.00 0.97 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1oyy h ALA 13 CO -0.06 -0.96 -0.31 0.87 0.00 0.00 0.00 179.25 178.78 1oyy h LYS 14 N -0.44 0.35 -0.13 0.00 1.57 -1.78 -0.90 116.57 115.24 1oyy h LYS 14 Ca 0.03 -0.14 0.03 0.00 -1.87 0.00 0.00 60.65 58.70 1oyy h LYS 14 Cb 0.54 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.77 1oyy h LYS 14 CO -0.39 0.64 -0.54 0.37 -0.57 0.00 0.00 179.45 178.96 1oyy h GLN 15 N 0.31 -0.56 -0.15 3.15 4.15 -0.60 -2.67 115.11 118.74 1oyy h GLN 15 Ca 0.04 0.04 0.03 0.00 0.77 0.00 0.00 58.65 59.53 1oyy h GLN 15 Cb 0.71 0.13 -0.03 0.00 0.21 0.00 0.00 27.48 28.50 1oyy h GLN 15 CO 0.05 -0.37 -0.05 0.28 -1.93 0.00 0.00 178.83 176.81 1oyy h VAL 16 N -0.58 0.81 -0.94 2.39 2.07 -0.24 0.21 116.25 119.97 1oyy h VAL 16 Ca 0.04 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.73 1oyy h VAL 16 Cb 0.68 0.81 -0.17 0.00 -1.52 0.00 0.00 31.29 31.09 1oyy h VAL 16 CO -0.44 0.00 -0.28 0.25 0.02 0.00 0.00 177.57 177.12 1oyy h LEU 17 N -0.03 -1.03 0.00 2.57 5.85 -0.99 2.03 115.31 123.72 1oyy h LEU 17 Ca 0.08 0.29 -0.00 0.00 0.84 0.00 0.00 57.88 59.08 1oyy h LEU 17 Cb 0.14 0.63 -0.00 0.00 0.37 0.00 0.00 40.66 41.80 1oyy h LEU 17 CO -0.17 -0.31 -0.02 1.56 -0.34 0.00 0.00 178.44 179.16 1oyy h GLN 18 N -0.01 0.00 0.05 1.25 4.20 -1.26 -1.93 115.11 117.41 1oyy h GLN 18 Ca 0.42 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.89 1oyy h GLN 18 Cb 0.66 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.43 1oyy h GLN 18 CO -0.96 0.93 -1.07 0.93 -0.67 0.00 0.00 178.83 177.99 1oyy h GLU 19 N -1.00 0.16 0.00 1.46 5.08 0.01 -2.51 114.58 117.78 1oyy h GLU 19 Ca -0.01 -0.25 -0.43 0.00 -1.00 0.00 0.00 59.36 57.67 1oyy h GLU 19 Cb 0.94 0.09 -0.07 0.00 0.50 0.00 0.00 28.75 30.21 1oyy h GLU 19 CO -0.00 1.08 -2.47 2.41 -1.00 0.00 0.00 179.01 179.02 1oyy n THR 20 N -3.51 1.52 -0.06 1.13 -1.04 0.68 -4.62 114.28 108.39 1oyy n THR 20 Ca -0.04 -0.44 0.12 0.00 -2.04 0.00 0.00 64.05 61.64 1oyy n THR 20 Cb 0.94 -1.73 0.29 0.00 -1.82 0.00 0.00 70.33 68.01 1oyy n THR 20 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1oyy n PHE 21 N -3.91 0.80 -0.61 -1.42 3.72 -1.00 -4.97 117.46 110.07 1oyy n PHE 21 Ca -0.51 -0.40 0.00 0.00 -0.05 0.00 0.00 57.45 56.49 1oyy n PHE 21 Cb 0.92 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.46 1oyy n PHE 21 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1oyy n GLY 22 N 1.59 0.07 3.83 1.37 0.00 -0.94 -4.90 105.19 106.22 1oyy n GLY 22 Ca 0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 1oyy n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1oyy s TYR 23 N -1.22 2.95 -0.27 1.61 2.02 -0.77 -4.87 117.35 116.79 1oyy s TYR 23 Ca 0.00 1.05 -0.10 0.00 -0.37 0.00 0.00 57.07 57.65 1oyy s TYR 23 Cb 0.00 -3.17 -0.13 0.00 -0.40 0.00 0.00 41.96 38.25 1oyy s TYR 23 CO 0.00 -1.67 -0.32 0.94 -1.57 0.00 0.00 175.55 172.93 1oyy n GLN 24 N -3.34 0.61 -4.18 -0.62 7.27 -1.26 -3.50 117.38 112.35 1oyy n GLN 24 Ca 0.07 0.24 -0.14 0.00 0.07 0.00 0.00 57.00 57.23 1oyy n GLN 24 Cb 0.57 -1.50 -0.11 0.00 2.41 0.00 0.00 30.24 31.61 1oyy n GLN 24 CO 0.00 0.00 0.00 -1.14 0.07 0.00 0.00 177.06 175.99 1oyy s GLN 25 N -2.51 0.85 0.38 3.69 0.74 -1.26 -4.86 119.66 116.69 1oyy s GLN 25 Ca -0.38 -1.16 -0.26 0.00 0.05 0.00 0.00 55.36 53.60 1oyy s GLN 25 Cb 0.13 -0.54 -0.09 0.00 1.10 0.00 0.00 33.01 33.61 1oyy s GLN 25 CO 0.52 0.08 1.23 -0.06 -0.55 0.00 0.00 175.29 176.51 1oyy s PHE 26 N -2.45 3.02 -0.16 1.67 0.08 -1.26 -5.03 117.98 113.85 1oyy s PHE 26 Ca 0.06 1.49 -0.21 0.00 0.12 0.00 0.00 56.93 58.39 1oyy s PHE 26 Cb -0.03 -3.53 -0.03 0.00 -0.57 0.00 0.00 43.02 38.87 1oyy s PHE 26 CO 0.00 -1.61 0.61 1.03 -0.10 0.00 0.00 175.22 175.15 1oyy s ARG 27 N -2.13 4.27 0.03 0.44 0.52 -1.26 -4.96 118.95 115.86 1oyy s ARG 27 Ca 0.55 0.62 -0.21 0.00 -0.52 0.00 0.00 55.73 56.17 1oyy s ARG 27 Cb -0.35 -3.53 -0.11 0.00 0.52 0.00 0.00 34.95 31.48 1oyy s ARG 27 CO 0.45 -0.12 0.54 -2.30 0.02 0.00 0.00 175.30 173.88 1oyy n PRO 28 N 4.61 0.00 0.00 3.54 -0.02 -1.26 -0.13 135.00 141.74 1oyy n PRO 28 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.46 1oyy n PRO 28 Cb 0.50 -0.79 0.00 0.00 -0.02 0.00 0.00 33.50 33.20 1oyy n PRO 28 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1oyy n GLY 29 N 0.92 2.85 0.29 -1.23 0.00 -1.26 -4.90 105.19 101.86 1oyy n GLY 29 Ca 0.11 -0.72 0.10 0.00 0.00 0.00 0.00 46.02 45.51 1oyy n GLY 29 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1oyy h GLN 30 N 0.00 0.21 -0.14 1.61 4.20 -0.90 -2.04 115.11 118.04 1oyy h GLN 30 Ca 0.00 -0.01 -0.09 0.00 0.06 0.00 0.00 58.65 58.61 1oyy h GLN 30 Cb 0.00 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.73 1oyy h GLN 30 CO 0.00 0.14 -0.25 1.49 -0.67 0.00 0.00 178.83 179.53 1oyy h GLU 31 N 0.21 0.42 -0.42 1.46 4.81 -1.91 -2.41 114.58 116.75 1oyy h GLU 31 Ca 0.49 -0.26 -0.00 0.00 -0.13 0.00 0.00 59.36 59.46 1oyy h GLU 31 Cb 0.94 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.33 1oyy h GLU 31 CO -0.62 0.86 0.26 1.49 -0.73 0.00 0.00 179.01 180.27 1oyy h GLU 32 N 0.02 0.55 -0.03 1.92 4.81 -1.78 0.40 114.58 120.48 1oyy h GLU 32 Ca 0.01 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 1oyy h GLU 32 Cb 0.84 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 30.10 1oyy h GLU 32 CO 0.06 0.38 -0.03 0.82 -0.73 0.00 0.00 179.01 179.51 1oyy h ILE 33 N 0.57 1.38 -0.89 2.32 1.08 -1.42 -2.18 117.51 118.36 1oyy h ILE 33 Ca 0.15 -1.16 -0.02 0.00 -0.39 0.00 0.00 64.86 63.44 1oyy h ILE 33 Cb -0.03 2.10 -0.04 0.00 -3.07 0.00 0.00 36.82 35.77 1oyy h ILE 33 CO -0.03 0.31 0.48 0.40 -0.69 0.00 0.00 178.15 178.62 1oyy h ILE 34 N -0.39 1.26 -0.07 -0.67 2.04 -0.77 0.92 117.51 119.83 1oyy h ILE 34 Ca 0.00 -0.65 -0.15 0.00 1.00 0.00 0.00 64.86 65.06 1oyy h ILE 34 Cb 0.52 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.66 1oyy h ILE 34 CO 0.01 0.29 -0.63 0.44 0.00 0.00 0.00 178.15 178.26 1oyy h ASP 35 N 1.24 0.31 -0.21 1.72 3.32 -0.30 0.90 116.42 123.41 1oyy h ASP 35 Ca 0.31 -0.19 -0.12 0.00 0.02 0.00 0.00 57.03 57.06 1oyy h ASP 35 Cb 0.04 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.50 1oyy h ASP 35 CO -0.05 0.86 -0.33 0.74 -1.72 0.00 0.00 179.24 178.75 1oyy h THR 36 N 0.20 1.33 -0.25 0.35 2.02 -0.74 -2.47 112.91 113.34 1oyy h THR 36 Ca -0.01 -1.54 -0.05 0.00 0.77 0.00 0.00 66.41 65.58 1oyy h THR 36 Cb 1.16 1.82 -0.01 0.00 -1.74 0.00 0.00 68.15 69.37 1oyy h THR 36 CO 0.10 0.48 -0.06 0.58 0.37 0.00 0.00 175.52 176.99 1oyy h VAL 37 N 0.27 1.19 0.00 3.16 2.07 0.14 -1.85 116.25 121.23 1oyy h VAL 37 Ca 0.02 -0.77 -0.05 0.00 0.82 0.00 0.00 66.70 66.72 1oyy h VAL 37 Cb 0.91 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 1oyy h VAL 37 CO 0.07 0.25 -0.24 -0.07 0.02 0.00 0.00 177.57 177.61 1oyy h LEU 38 N 0.38 0.00 -0.41 2.57 3.38 -0.55 -2.54 115.31 118.13 1oyy h LEU 38 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1oyy h LEU 38 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1oyy h LEU 38 CO 0.02 0.24 0.00 -1.54 0.09 0.00 0.00 178.44 177.24 1oyy n SER 39 N -3.38 0.61 0.00 -0.43 3.41 -0.71 -4.89 113.62 108.23 1oyy n SER 39 Ca 0.00 0.62 0.00 0.00 -0.26 0.00 0.00 58.87 59.23 1oyy n SER 39 Cb 0.45 -0.76 0.00 0.00 -0.26 0.00 0.00 64.21 63.64 1oyy n SER 39 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1oyy n GLY 40 N 0.43 0.76 3.70 5.00 0.00 -0.96 -5.05 105.19 109.07 1oyy n GLY 40 Ca 0.03 -0.07 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 1oyy n GLY 40 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1oyy s ARG 41 N -0.59 4.17 0.52 1.61 3.52 -1.11 -4.78 118.95 122.29 1oyy s ARG 41 Ca 0.00 -0.12 -0.18 0.00 -0.13 0.00 0.00 55.73 55.29 1oyy s ARG 41 Cb 0.00 -3.47 -0.12 0.00 -1.56 0.00 0.00 34.95 29.80 1oyy s ARG 41 CO 0.00 0.18 0.21 -0.25 -0.81 0.00 0.00 175.30 174.63 1oyy n ASP 42 N 3.87 -2.29 -3.82 -2.12 9.92 -1.26 -4.48 116.55 116.36 1oyy n ASP 42 Ca -0.14 0.72 -0.12 0.00 -0.53 0.00 0.00 54.79 54.72 1oyy n ASP 42 Cb 0.52 -1.01 -0.11 0.00 -0.64 0.00 0.00 41.12 39.88 1oyy n ASP 42 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1oyy s LEU 44 N -0.73 2.99 -0.32 0.00 2.96 -0.65 0.13 118.68 123.06 1oyy s LEU 44 Ca -0.08 -1.14 -0.08 0.00 -0.22 0.00 0.00 54.13 52.61 1oyy s LEU 44 Cb -0.05 -1.53 0.02 0.00 0.50 0.00 0.00 46.19 45.13 1oyy s LEU 44 CO 0.01 -0.12 0.12 -0.69 -1.32 0.00 0.00 176.35 174.35 1oyy s VAL 45 N 1.17 4.15 -0.68 1.68 1.01 -0.95 -1.28 120.40 125.49 1oyy s VAL 45 Ca -0.04 -0.79 -0.02 0.00 0.00 0.00 0.00 61.98 61.13 1oyy s VAL 45 Cb -0.18 -3.22 0.17 0.00 0.00 0.00 0.00 36.38 33.16 1oyy s VAL 45 CO -0.08 -0.05 0.50 -0.69 0.00 0.00 0.00 175.10 174.78 1oyy s VAL 46 N 1.50 3.75 -0.15 2.92 1.01 -0.44 -1.69 120.40 127.30 1oyy s VAL 46 Ca 0.02 -3.24 -0.06 0.00 0.00 0.00 0.00 61.98 58.70 1oyy s VAL 46 Cb -0.18 -3.42 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 1oyy s VAL 46 CO 0.04 -0.92 0.06 -0.04 0.00 0.00 0.00 175.10 174.24 1oyy s MET 47 N -0.42 3.69 1.10 2.72 -1.94 -0.96 0.21 119.30 123.69 1oyy s MET 47 Ca 0.19 -0.32 -0.12 0.00 -1.71 0.00 0.00 55.69 53.73 1oyy s MET 47 Cb -0.17 -3.13 0.24 0.00 2.01 0.00 0.00 34.83 33.78 1oyy s MET 47 CO -0.06 0.45 1.00 -0.35 -0.01 0.00 0.00 175.02 176.05 1oyy n PRO 48 N 2.98 -1.82 -1.37 2.03 -0.04 -1.26 -3.86 135.00 131.66 1oyy n PRO 48 Ca -0.18 -0.49 -0.51 0.00 -0.04 0.00 0.00 63.50 62.28 1oyy n PRO 48 Cb 0.53 -2.20 -0.12 0.00 -0.04 0.00 0.00 33.50 31.67 1oyy n PRO 48 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1oyy n THR 49 N -4.73 0.02 -2.73 0.52 -2.24 -1.26 -0.14 114.28 103.72 1oyy n THR 49 Ca 0.06 -0.07 -0.12 0.00 -2.27 0.00 0.00 64.05 61.64 1oyy n THR 49 Cb 0.54 -0.74 0.02 0.00 -2.10 0.00 0.00 70.33 68.05 1oyy n THR 49 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1oyy n GLY 50 N 6.98 0.04 0.06 3.38 0.00 -1.26 -4.92 105.19 109.47 1oyy n GLY 50 Ca 0.56 -0.27 0.13 0.00 0.00 0.00 0.00 46.02 46.45 1oyy n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oyy n GLY 51 N -1.20 -1.61 0.00 -0.02 0.00 0.81 -4.88 105.19 98.29 1oyy n GLY 51 Ca -0.05 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1oyy n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oyy n GLY 52 N 1.38 0.69 0.08 -0.02 0.00 -1.26 -4.94 105.19 101.12 1oyy n GLY 52 Ca 0.06 -0.43 -0.09 0.00 0.00 0.00 0.00 46.02 45.56 1oyy n GLY 52 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1oyy h LYS 53 N 0.00 0.02 -0.14 1.61 1.57 -1.93 -3.37 116.57 114.33 1oyy h LYS 53 Ca 0.00 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.69 1oyy h LYS 53 Cb 0.00 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1oyy h LYS 53 CO 0.00 0.67 -0.15 0.77 -0.57 0.00 0.00 179.45 180.17 1oyy h SER 54 N 0.01 0.21 -0.88 0.86 0.02 -2.02 -2.41 113.55 109.35 1oyy h SER 54 Ca -0.22 -0.05 0.02 0.00 -0.84 0.00 0.00 61.79 60.71 1oyy h SER 54 Cb 1.95 -0.06 -0.05 0.00 0.14 0.00 0.00 62.40 64.39 1oyy h SER 54 CO 0.10 0.39 0.58 -0.07 -1.14 0.00 0.00 176.83 176.68 1oyy h LEU 55 N 0.21 0.97 -2.05 5.07 3.38 -1.98 0.29 115.31 121.21 1oyy h LEU 55 Ca 0.04 -0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.07 1oyy h LEU 55 Cb 0.40 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1oyy h LEU 55 CO 0.02 0.69 0.36 0.00 0.09 0.00 0.00 178.44 179.61 1oyy n TYR 57 N -3.54 0.00 -0.12 0.00 0.18 -0.91 -4.60 117.16 108.17 1oyy n TYR 57 Ca 0.04 0.00 -0.05 0.00 1.88 0.00 0.00 57.90 59.77 1oyy n TYR 57 Cb 0.50 -0.42 0.14 0.00 -0.38 0.00 0.00 39.34 39.18 1oyy n TYR 57 CO 0.00 0.00 0.00 1.96 -2.08 0.00 0.00 176.86 176.74 1oyy h GLN 58 N 0.00 0.83 -0.28 -3.48 4.20 0.17 -2.22 115.11 114.33 1oyy h GLN 58 Ca -0.22 -0.23 -0.07 0.00 0.06 0.00 0.00 58.65 58.19 1oyy h GLN 58 Cb 1.46 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 29.14 1oyy h GLN 58 CO 0.01 0.84 -0.10 0.82 -0.67 0.00 0.00 178.83 179.73 1oyy h ILE 59 N 0.77 1.29 -0.45 2.54 2.04 -1.42 -2.44 117.51 119.84 1oyy h ILE 59 Ca 0.15 -1.16 -0.07 0.00 1.00 0.00 0.00 64.86 64.78 1oyy h ILE 59 Cb 0.47 1.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.99 1oyy h ILE 59 CO 0.02 0.37 -0.01 1.55 0.00 0.00 0.00 178.15 180.08 1oyy h PRO 60 N 0.31 0.74 -0.82 2.37 0.13 -1.76 -0.02 132.00 132.95 1oyy h PRO 60 Ca 0.07 -0.20 -0.02 0.00 -0.87 0.00 0.00 66.00 64.98 1oyy h PRO 60 Cb 0.60 -0.09 -0.04 0.00 0.13 0.00 0.00 31.00 31.60 1oyy h PRO 60 CO 0.03 0.76 0.42 0.00 -0.23 0.00 0.00 178.00 178.99 1oyy h ALA 61 N 1.29 1.19 -0.03 -0.56 0.00 -1.29 0.64 119.26 120.50 1oyy h ALA 61 Ca 0.14 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 1oyy h ALA 61 Cb 0.45 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1oyy h ALA 61 CO 0.02 0.63 -0.61 -0.07 0.00 0.00 0.00 179.25 179.23 1oyy h LEU 62 N 1.16 0.13 -0.98 0.00 3.38 -0.72 -3.01 115.31 115.28 1oyy h LEU 62 Ca 0.29 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1oyy h LEU 62 Cb 0.08 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1oyy h LEU 62 CO -0.04 0.71 0.00 0.18 0.09 0.00 0.00 178.44 179.38 1oyy n LEU 63 N -3.85 1.49 -4.69 1.67 4.77 0.02 -2.27 117.00 114.15 1oyy n LEU 63 Ca -0.02 -0.56 -0.25 0.00 -0.03 0.00 0.00 56.01 55.16 1oyy n LEU 63 Cb 0.61 -0.04 -0.08 0.00 -2.33 0.00 0.00 43.42 41.58 1oyy n LEU 63 CO 0.43 0.28 -0.22 -0.76 -1.33 0.00 0.00 177.39 175.79 1oyy s LEU 64 N -1.81 3.08 -0.17 2.23 1.43 -0.05 -4.38 118.68 119.01 1oyy s LEU 64 Ca 0.36 -1.00 -0.10 0.00 -1.03 0.00 0.00 54.13 52.35 1oyy s LEU 64 Cb 0.19 -1.43 -0.05 0.00 0.03 0.00 0.00 46.19 44.93 1oyy s LEU 64 CO 0.30 -0.38 0.17 0.20 0.23 0.00 0.00 176.35 176.87 1oyy s ASN 65 N -3.81 6.31 0.00 2.29 0.01 -1.25 -2.87 114.94 115.61 1oyy s ASN 65 Ca 0.38 0.36 0.00 0.00 -0.71 0.00 0.00 52.86 52.89 1oyy s ASN 65 Cb 0.02 -2.11 0.00 0.00 0.41 0.00 0.00 41.25 39.57 1oyy s ASN 65 CO 0.21 0.22 0.00 0.61 -1.51 0.00 0.00 177.10 176.63 1oyy n GLY 66 N 3.10 0.83 3.52 0.66 0.00 -0.25 -4.75 105.19 108.30 1oyy n GLY 66 Ca -0.16 -2.33 -0.39 0.00 0.00 0.00 0.00 46.02 43.15 1oyy n GLY 66 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1oyy s LEU 67 N 0.00 4.14 -0.23 0.99 2.96 -0.29 -4.70 118.68 121.55 1oyy s LEU 67 Ca 0.00 -0.27 -0.23 0.00 -0.22 0.00 0.00 54.13 53.41 1oyy s LEU 67 Cb 0.00 -2.08 -0.01 0.00 0.50 0.00 0.00 46.19 44.60 1oyy s LEU 67 CO 0.00 -0.14 0.76 -0.89 -1.32 0.00 0.00 176.35 174.76 1oyy s THR 68 N 1.70 4.90 -0.21 3.68 2.01 -0.89 -1.16 115.64 125.67 1oyy s THR 68 Ca 0.06 1.43 -0.10 0.00 0.31 0.00 0.00 61.69 63.39 1oyy s THR 68 Cb -0.17 -4.06 -0.05 0.00 0.01 0.00 0.00 72.50 68.24 1oyy s THR 68 CO 0.09 -0.02 0.14 -0.69 -0.69 0.00 0.00 174.62 173.46 1oyy s VAL 69 N 2.58 5.39 -0.22 3.82 1.01 0.27 -2.20 120.40 131.06 1oyy s VAL 69 Ca 0.33 0.20 -0.01 0.00 0.00 0.00 0.00 61.98 62.50 1oyy s VAL 69 Cb -0.16 -3.48 0.02 0.00 0.00 0.00 0.00 36.38 32.76 1oyy s VAL 69 CO 0.08 0.41 -0.10 -0.69 0.00 0.00 0.00 175.10 174.80 1oyy s VAL 70 N 0.56 2.66 -0.13 2.92 1.01 0.32 -0.24 120.40 127.49 1oyy s VAL 70 Ca 0.08 -0.96 -0.12 0.00 0.00 0.00 0.00 61.98 60.99 1oyy s VAL 70 Cb -0.12 -2.28 -0.05 0.00 0.00 0.00 0.00 36.38 33.94 1oyy s VAL 70 CO -0.00 0.32 0.25 -0.69 0.00 0.00 0.00 175.10 174.98 1oyy s VAL 71 N 1.32 5.33 -0.17 2.92 1.01 -0.82 -0.91 120.40 129.09 1oyy s VAL 71 Ca 0.02 0.45 -0.21 0.00 0.00 0.00 0.00 61.98 62.24 1oyy s VAL 71 Cb -0.15 -3.56 0.05 0.00 0.00 0.00 0.00 36.38 32.72 1oyy s VAL 71 CO -0.07 0.48 0.57 -0.55 0.00 0.00 0.00 175.10 175.53 1oyy s SER 72 N -0.12 -0.57 0.00 3.32 0.15 -1.02 -1.53 113.70 113.94 1oyy s SER 72 Ca 0.16 0.97 0.26 0.00 0.70 0.00 0.00 55.95 58.04 1oyy s SER 72 Cb -0.13 0.97 0.71 0.00 -1.71 0.00 0.00 66.02 65.87 1oyy s SER 72 CO 0.04 -0.30 1.54 -0.81 1.20 0.00 0.00 173.24 174.92 1oyy n PRO 73 N 2.29 0.72 -2.43 5.44 -0.04 -1.26 -4.18 135.00 135.52 1oyy n PRO 73 Ca -0.15 -0.42 -0.42 0.00 -0.04 0.00 0.00 63.50 62.47 1oyy n PRO 73 Cb 0.56 -1.49 0.01 0.00 -0.04 0.00 0.00 33.50 32.54 1oyy n PRO 73 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1oyy n LEU 74 N -0.77 7.18 -4.70 1.53 7.99 -1.26 -5.00 117.00 121.96 1oyy n LEU 74 Ca 0.11 -4.99 -0.42 0.00 -0.01 0.00 0.00 56.01 50.70 1oyy n LEU 74 Cb 0.35 -1.34 -0.03 0.00 -0.11 0.00 0.00 43.42 42.29 1oyy n LEU 74 CO 0.27 1.79 1.28 -0.63 -1.51 0.00 0.00 177.39 178.59 1oyy s ILE 75 N -1.71 2.83 0.00 -0.08 1.09 -1.26 -1.92 121.20 120.15 1oyy s ILE 75 Ca 0.42 0.47 0.00 0.00 -1.10 0.00 0.00 60.65 60.44 1oyy s ILE 75 Cb 0.13 -3.30 0.00 0.00 -1.06 0.00 0.00 42.46 38.23 1oyy s ILE 75 CO -0.03 0.02 0.00 -0.24 -0.10 0.00 0.00 174.94 174.59 1oyy n SER 76 N 4.80 -0.48 0.00 3.58 2.88 -1.26 -4.77 113.62 118.37 1oyy n SER 76 Ca 0.15 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.69 1oyy n SER 76 Cb 0.40 -0.12 0.00 0.00 -0.75 0.00 0.00 64.21 63.74 1oyy n SER 76 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1oyy n LEU 77 N -0.34 0.00 -0.04 2.46 7.94 -1.23 -4.90 117.00 120.88 1oyy n LEU 77 Ca 0.00 0.00 -0.11 0.00 -1.11 0.00 0.00 56.01 54.79 1oyy n LEU 77 Cb 0.12 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.02 1oyy n LEU 77 CO 0.00 0.00 0.87 0.00 -1.11 0.00 0.00 177.39 177.15 1oyy h MET 78 N 0.00 0.23 -0.97 1.96 -0.00 -1.68 0.12 114.93 114.59 1oyy h MET 78 Ca 0.00 -0.03 0.10 0.00 -0.00 0.00 0.00 59.70 59.77 1oyy h MET 78 Cb 0.00 -0.04 -0.07 0.00 -0.00 0.00 0.00 31.60 31.48 1oyy h MET 78 CO 0.00 0.27 0.62 -0.22 -0.00 0.00 0.00 176.91 177.58 1oyy h LYS 79 N 0.13 0.97 0.00 -0.10 3.64 -1.91 0.19 116.57 119.49 1oyy h LYS 79 Ca 0.05 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1oyy h LYS 79 Cb 0.12 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 1oyy h LYS 79 CO -0.01 0.64 0.00 -0.25 -2.27 0.00 0.00 179.45 177.56 1oyy n ASP 80 N -4.56 0.64 0.08 4.20 8.00 -0.30 -2.23 116.55 122.37 1oyy n ASP 80 Ca 0.17 0.59 -0.21 0.00 0.71 0.00 0.00 54.79 56.06 1oyy n ASP 80 Cb 0.31 -0.75 -0.15 0.00 -0.02 0.00 0.00 41.12 40.51 1oyy n ASP 80 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 1oyy h GLN 81 N 0.00 0.35 0.22 -1.24 1.08 0.19 -3.33 115.11 112.38 1oyy h GLN 81 Ca 0.00 -0.60 0.01 0.00 -1.45 0.00 0.00 58.65 56.61 1oyy h GLN 81 Cb 0.56 0.23 -0.03 0.00 -0.05 0.00 0.00 27.48 28.18 1oyy h GLN 81 CO 0.00 1.25 -0.38 0.28 -0.95 0.00 0.00 178.83 179.04 1oyy h VAL 82 N 0.10 0.23 -0.58 -0.54 2.07 -1.04 0.12 116.25 116.61 1oyy h VAL 82 Ca -0.29 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.26 1oyy h VAL 82 Cb 2.08 0.23 -0.04 0.00 -1.52 0.00 0.00 31.29 32.04 1oyy h VAL 82 CO 0.18 0.00 0.35 0.44 0.02 0.00 0.00 177.57 178.56 1oyy h ASP 83 N -0.67 0.56 -0.38 0.57 3.32 -1.64 0.78 116.42 118.95 1oyy h ASP 83 Ca 0.00 0.01 -0.11 0.00 0.02 0.00 0.00 57.03 56.95 1oyy h ASP 83 Cb 0.66 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.09 1oyy h ASP 83 CO -0.16 0.39 -0.19 1.56 -1.72 0.00 0.00 179.24 179.12 1oyy h GLN 84 N 0.68 0.80 -0.64 3.56 1.08 -1.64 0.48 115.11 119.44 1oyy h GLN 84 Ca 0.24 -0.35 -0.03 0.00 -1.45 0.00 0.00 58.65 57.05 1oyy h GLN 84 Cb 0.04 -0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.42 1oyy h GLN 84 CO -0.11 0.98 0.28 -0.07 -0.95 0.00 0.00 178.83 178.96 1oyy h LEU 85 N 0.61 0.86 -0.94 1.46 3.38 0.12 -0.82 115.31 119.97 1oyy h LEU 85 Ca 0.09 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 1oyy h LEU 85 Cb 0.74 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 1oyy h LEU 85 CO 0.06 0.77 0.17 1.56 0.09 0.00 0.00 178.44 181.09 1oyy h GLN 86 N 0.88 0.95 -0.40 1.13 1.08 0.90 0.19 115.11 119.84 1oyy h GLN 86 Ca 0.21 -0.19 0.08 0.00 -1.45 0.00 0.00 58.65 57.30 1oyy h GLN 86 Cb 0.17 -0.14 -0.07 0.00 -0.05 0.00 0.00 27.48 27.39 1oyy h GLN 86 CO -0.02 0.83 -0.04 0.00 -0.95 0.00 0.00 178.83 178.65 1oyy h ALA 87 N 1.27 0.32 0.00 3.87 0.00 0.11 0.12 119.26 124.95 1oyy h ALA 87 Ca 0.20 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1oyy h ALA 87 Cb 0.29 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1oyy h ALA 87 CO -0.00 -0.42 0.00 0.09 0.00 0.00 0.00 179.25 178.91 1oyy n ASN 88 N -5.24 0.48 0.00 0.00 3.02 -0.42 -4.83 115.26 108.26 1oyy n ASN 88 Ca 0.02 -1.75 0.00 0.00 -0.03 0.00 0.00 54.58 52.83 1oyy n ASN 88 Cb 0.21 -0.24 0.00 0.00 -0.61 0.00 0.00 39.78 39.15 1oyy n ASN 88 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1oyy n GLY 89 N 0.21 1.71 3.68 7.41 0.00 0.40 -5.00 105.19 113.59 1oyy n GLY 89 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1oyy n GLY 89 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oyy s VAL 90 N -3.14 4.66 -1.37 1.61 1.01 0.62 -4.94 120.40 118.84 1oyy s VAL 90 Ca 0.00 1.95 -0.16 0.00 0.00 0.00 0.00 61.98 63.77 1oyy s VAL 90 Cb 0.00 -4.26 0.05 0.00 0.00 0.00 0.00 36.38 32.17 1oyy s VAL 90 CO 0.00 -0.06 1.98 0.00 0.00 0.00 0.00 175.10 177.03 1oyy n ALA 91 N 5.49 4.51 -2.28 5.51 0.00 -1.26 -2.59 120.51 129.89 1oyy n ALA 91 Ca 0.10 -3.85 -0.19 0.00 0.00 0.00 0.00 53.44 49.50 1oyy n ALA 91 Cb 0.47 -3.57 0.01 0.00 0.00 0.00 0.00 19.45 16.36 1oyy n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1oyy s ALA 92 N 3.81 4.18 0.03 0.00 0.00 -1.26 -0.99 121.76 127.53 1oyy s ALA 92 Ca 0.51 -1.42 -0.28 0.00 0.00 0.00 0.00 51.96 50.77 1oyy s ALA 92 Cb 0.09 -1.80 0.09 0.00 0.00 0.00 0.00 23.12 21.51 1oyy s ALA 92 CO -0.00 -0.24 0.91 0.00 0.00 0.00 0.00 175.76 176.43 1oyy s ALA 93 N -2.35 -1.79 0.23 0.00 0.00 -0.04 -4.91 121.76 112.89 1oyy s ALA 93 Ca 0.49 0.83 0.04 0.00 0.00 0.00 0.00 51.96 53.32 1oyy s ALA 93 Cb -0.10 0.46 -0.05 0.00 0.00 0.00 0.00 23.12 23.43 1oyy s ALA 93 CO 0.34 -0.76 -0.02 0.00 0.00 0.00 0.00 175.76 175.32 1oyy s LEU 95 N -3.31 -0.91 0.31 0.00 2.96 0.37 -4.89 118.68 113.22 1oyy s LEU 95 Ca 0.27 -0.12 0.03 0.00 -0.22 0.00 0.00 54.13 54.09 1oyy s LEU 95 Cb 0.05 1.30 -0.04 0.00 0.50 0.00 0.00 46.19 48.00 1oyy s LEU 95 CO 0.08 -0.33 0.12 0.54 -1.32 0.00 0.00 176.35 175.44 1oyy s ASN 96 N 2.60 1.78 0.00 3.68 6.03 -1.26 -2.70 114.94 125.07 1oyy s ASN 96 Ca 0.11 -1.49 0.24 0.00 -1.03 0.00 0.00 52.86 50.70 1oyy s ASN 96 Cb -0.13 0.25 1.05 0.00 -3.03 0.00 0.00 41.25 39.39 1oyy s ASN 96 CO -0.27 -0.79 1.78 -1.20 -2.03 0.00 0.00 177.10 174.60 1oyy n SER 97 N -0.80 0.00 0.23 3.54 7.64 -1.26 -2.53 113.62 120.45 1oyy n SER 97 Ca -0.01 0.49 0.13 0.00 1.01 0.00 0.00 58.87 60.48 1oyy n SER 97 Cb 0.66 -0.49 0.37 0.00 -1.01 0.00 0.00 64.21 63.74 1oyy n SER 97 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1oyy h THR 98 N 0.00 0.17 -4.37 0.44 1.03 -2.04 -3.44 112.91 104.68 1oyy h THR 98 Ca 0.00 -0.97 -0.49 0.00 -0.01 0.00 0.00 66.41 64.94 1oyy h THR 98 Cb 0.42 1.84 0.09 0.00 -1.07 0.00 0.00 68.15 69.43 1oyy h THR 98 CO 0.00 0.08 0.38 -1.10 -0.01 0.00 0.00 175.52 174.87 1oyy s GLN 99 N -3.41 2.54 0.55 0.00 -0.21 -1.05 -5.08 119.66 113.00 1oyy s GLN 99 Ca 0.04 0.60 -0.17 0.00 0.02 0.00 0.00 55.36 55.85 1oyy s GLN 99 Cb 0.07 -1.97 -0.06 0.00 1.00 0.00 0.00 33.01 32.05 1oyy s GLN 99 CO 0.63 -1.29 1.02 0.95 -2.12 0.00 0.00 175.29 174.49 1oyy s THR 100 N -3.23 4.10 0.50 -0.19 -4.23 -1.26 -4.87 115.64 106.47 1oyy s THR 100 Ca 0.59 1.04 0.31 0.00 -1.18 0.00 0.00 61.69 62.45 1oyy s THR 100 Cb -0.13 -3.52 0.35 0.00 1.34 0.00 0.00 72.50 70.53 1oyy s THR 100 CO 0.53 -0.55 2.19 -0.09 -0.54 0.00 0.00 174.62 176.16 1oyy h ARG 101 N 0.77 0.00 -0.07 3.99 2.43 -1.98 0.20 114.38 119.72 1oyy h ARG 101 Ca -0.47 0.00 -0.24 0.00 -0.81 0.00 0.00 59.98 58.46 1oyy h ARG 101 Cb 1.21 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 30.77 1oyy h ARG 101 CO 0.59 0.05 -0.87 1.49 -1.51 0.00 0.00 179.97 179.72 1oyy h GLU 102 N 0.00 0.72 0.02 0.20 4.81 -1.99 -2.59 114.58 115.75 1oyy h GLU 102 Ca -0.00 -0.68 -0.22 0.00 -0.13 0.00 0.00 59.36 58.33 1oyy h GLU 102 Cb 0.17 0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.71 1oyy h GLU 102 CO 0.01 1.27 -0.95 0.37 -0.73 0.00 0.00 179.01 178.98 1oyy h GLN 103 N 0.42 0.30 -0.38 1.92 4.15 -1.06 -2.89 115.11 117.57 1oyy h GLN 103 Ca -0.09 -0.35 -0.12 0.00 0.77 0.00 0.00 58.65 58.87 1oyy h GLN 103 Cb 1.52 0.10 -0.01 0.00 0.21 0.00 0.00 27.48 29.30 1oyy h GLN 103 CO 0.18 1.05 -0.23 1.96 -1.93 0.00 0.00 178.83 179.86 1oyy h GLN 104 N 0.16 0.83 -0.02 1.69 4.20 -1.18 -2.81 115.11 117.98 1oyy h GLN 104 Ca -0.07 -0.38 -0.03 0.00 0.06 0.00 0.00 58.65 58.22 1oyy h GLN 104 Cb 1.59 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 29.35 1oyy h GLN 104 CO 0.15 1.02 -0.15 -0.07 -0.67 0.00 0.00 178.83 179.11 1oyy h LEU 105 N 0.63 0.02 -0.64 1.46 3.38 -1.41 -1.25 115.31 117.51 1oyy h LEU 105 Ca 0.08 -0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.90 1oyy h LEU 105 Cb 0.79 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 1oyy h LEU 105 CO 0.06 0.18 -0.66 -0.33 0.09 0.00 0.00 178.44 177.78 1oyy h GLU 106 N 0.03 0.09 0.16 1.13 5.08 -1.28 0.44 114.58 120.22 1oyy h GLU 106 Ca 0.00 -0.07 -0.30 0.00 -1.00 0.00 0.00 59.36 58.00 1oyy h GLU 106 Cb 0.29 0.01 0.02 0.00 0.50 0.00 0.00 28.75 29.57 1oyy h GLU 106 CO 0.02 0.72 -1.30 0.28 -1.00 0.00 0.00 179.01 177.73 1oyy h VAL 107 N 0.06 1.37 -0.40 3.13 2.07 -1.26 -3.04 116.25 118.19 1oyy h VAL 107 Ca -0.01 -2.76 -0.00 0.00 0.82 0.00 0.00 66.70 64.75 1oyy h VAL 107 Cb 1.18 2.88 -0.02 0.00 -1.52 0.00 0.00 31.29 33.81 1oyy h VAL 107 CO 0.09 0.82 0.25 0.24 0.02 0.00 0.00 177.57 178.99 1oyy h MET 108 N 0.15 0.53 0.00 1.57 2.86 -0.96 -1.78 114.93 117.31 1oyy h MET 108 Ca -0.18 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.41 1oyy h MET 108 Cb 2.00 -0.11 -0.00 0.00 0.06 0.00 0.00 31.60 33.54 1oyy h MET 108 CO 0.23 0.38 -0.01 1.15 1.06 0.00 0.00 176.91 179.73 1oyy h THR 109 N 0.53 0.10 0.00 2.22 2.02 -1.02 0.92 112.91 117.68 1oyy h THR 109 Ca 0.14 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1oyy h THR 109 Cb -0.02 1.14 0.00 0.00 -1.74 0.00 0.00 68.15 67.53 1oyy h THR 109 CO -0.03 0.01 -1.01 0.61 0.37 0.00 0.00 175.52 175.48 1oyy n GLY 110 N -0.83 -1.40 0.10 2.16 0.00 -0.73 -3.24 105.19 101.25 1oyy n GLY 110 Ca -0.02 -0.27 -0.19 0.00 0.00 0.00 0.00 46.02 45.54 1oyy n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oyy h ARG 112 N -0.75 -0.30 -0.15 0.00 2.43 -1.05 -2.34 114.38 112.23 1oyy h ARG 112 Ca -0.19 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.00 1oyy h ARG 112 Cb 1.36 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.97 1oyy h ARG 112 CO -0.02 -0.20 0.00 0.25 -1.51 0.00 0.00 179.97 178.49 1oyy n THR 113 N -5.39 0.19 -1.96 0.20 -2.24 -1.20 -4.87 114.28 99.01 1oyy n THR 113 Ca -0.01 -0.24 -0.17 0.00 -2.27 0.00 0.00 64.05 61.36 1oyy n THR 113 Cb 0.34 0.12 -0.03 0.00 -2.10 0.00 0.00 70.33 68.66 1oyy n THR 113 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1oyy n GLY 114 N 0.93 0.52 0.03 3.38 0.00 -0.88 -4.87 105.19 104.29 1oyy n GLY 114 Ca 0.12 -0.20 0.14 0.00 0.00 0.00 0.00 46.02 46.07 1oyy n GLY 114 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1oyy n GLN 115 N -2.56 0.28 -4.99 1.61 1.13 -0.33 0.49 117.38 113.00 1oyy n GLN 115 Ca -0.18 -0.06 -0.32 0.00 -1.94 0.00 0.00 57.00 54.49 1oyy n GLN 115 Cb 0.61 -1.50 -0.16 0.00 0.11 0.00 0.00 30.24 29.30 1oyy n GLN 115 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1oyy s ILE 116 N -2.76 2.52 -0.16 5.09 1.01 0.17 -4.40 121.20 122.67 1oyy s ILE 116 Ca 0.21 -0.85 -0.02 0.00 0.00 0.00 0.00 60.65 59.98 1oyy s ILE 116 Cb 0.19 -2.02 -0.23 0.00 0.01 0.00 0.00 42.46 40.42 1oyy s ILE 116 CO 0.52 0.54 0.18 -1.14 0.00 0.00 0.00 174.94 175.05 1oyy n ARG 117 N 3.55 0.72 -3.87 2.79 0.63 -0.16 -4.72 116.66 115.59 1oyy n ARG 117 Ca -0.19 0.22 -0.26 0.00 -0.92 0.00 0.00 57.85 56.71 1oyy n ARG 117 Cb 0.53 -1.65 -0.17 0.00 0.45 0.00 0.00 32.46 31.62 1oyy n ARG 117 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 1oyy s LEU 118 N -6.79 1.02 -0.25 6.15 0.20 -0.91 -2.09 118.68 116.01 1oyy s LEU 118 Ca -0.25 -0.24 0.02 0.00 0.69 0.00 0.00 54.13 54.35 1oyy s LEU 118 Cb 0.07 -0.73 0.06 0.00 -0.43 0.00 0.00 46.19 45.16 1oyy s LEU 118 CO 0.72 -0.14 -0.09 -0.22 -0.29 0.00 0.00 176.35 176.33 1oyy s LEU 119 N 1.78 3.09 -0.30 -0.68 2.96 -0.93 -0.86 118.68 123.74 1oyy s LEU 119 Ca 0.05 -1.31 -0.21 0.00 -0.22 0.00 0.00 54.13 52.45 1oyy s LEU 119 Cb -0.12 -1.40 -0.01 0.00 0.50 0.00 0.00 46.19 45.15 1oyy s LEU 119 CO -0.07 -0.21 0.66 -0.31 -1.32 0.00 0.00 176.35 175.10 1oyy s TYR 120 N 1.22 3.22 -0.01 5.38 1.51 0.14 -0.52 117.35 128.29 1oyy s TYR 120 Ca -0.08 0.64 0.04 0.00 -1.01 0.00 0.00 57.07 56.66 1oyy s TYR 120 Cb -0.19 -3.02 -0.01 0.00 -0.11 0.00 0.00 41.96 38.62 1oyy s TYR 120 CO -0.06 -0.48 -0.13 -1.50 -1.11 0.00 0.00 175.55 172.27 1oyy s ILE 121 N 2.66 1.06 0.45 2.71 2.07 -0.09 -0.47 121.20 129.59 1oyy s ILE 121 Ca 0.26 -0.57 -0.24 0.00 -1.41 0.00 0.00 60.65 58.69 1oyy s ILE 121 Cb -0.15 -0.89 -0.07 0.00 0.13 0.00 0.00 42.46 41.48 1oyy s ILE 121 CO 0.12 0.30 1.20 0.00 -1.91 0.00 0.00 174.94 174.64 1oyy s ALA 122 N -0.31 3.02 0.14 1.50 0.00 -1.10 -2.43 121.76 122.58 1oyy s ALA 122 Ca 0.05 1.00 -0.23 0.00 0.00 0.00 0.00 51.96 52.78 1oyy s ALA 122 Cb -0.05 -3.41 -0.00 0.00 0.00 0.00 0.00 23.12 19.66 1oyy s ALA 122 CO -0.01 -0.71 1.64 -1.35 0.00 0.00 0.00 175.76 175.33 1oyy h PRO 123 N 2.18 -0.28 -0.79 0.00 0.11 -1.89 -1.27 132.00 130.05 1oyy h PRO 123 Ca -0.49 0.02 0.19 0.00 0.11 0.00 0.00 66.00 65.82 1oyy h PRO 123 Cb 1.25 0.06 -0.13 0.00 0.11 0.00 0.00 31.00 32.29 1oyy h PRO 123 CO 0.61 -0.19 0.09 1.05 -0.21 0.00 0.00 178.00 179.35 1oyy h GLU 124 N -0.29 0.15 -0.56 1.05 9.09 -1.94 -1.92 114.58 120.17 1oyy h GLU 124 Ca 0.11 -0.01 -0.10 0.00 0.05 0.00 0.00 59.36 59.41 1oyy h GLU 124 Cb 0.45 -0.03 -0.02 0.00 -1.65 0.00 0.00 28.75 27.50 1oyy h GLU 124 CO -0.32 0.10 -0.04 -0.09 0.05 0.00 0.00 179.01 178.71 1oyy h ARG 125 N 0.15 0.99 0.00 1.06 9.65 -1.58 -2.99 114.38 121.67 1oyy h ARG 125 Ca 0.45 -0.32 -0.04 0.00 -1.10 0.00 0.00 59.98 58.98 1oyy h ARG 125 Cb 0.84 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 29.33 1oyy h ARG 125 CO -0.65 1.00 -0.17 1.25 2.80 0.00 0.00 179.97 184.20 1oyy h LEU 126 N 0.90 0.00 -1.14 3.80 5.85 -0.92 -2.87 115.31 120.93 1oyy h LEU 126 Ca 0.16 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.88 1oyy h LEU 126 Cb 0.58 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.61 1oyy h LEU 126 CO 0.03 0.17 -0.32 0.23 -0.34 0.00 0.00 178.44 178.21 1oyy n MET 127 N -3.95 1.54 -3.93 1.25 0.00 -1.10 -4.10 117.12 106.82 1oyy n MET 127 Ca -0.02 -1.09 -0.29 0.00 0.00 0.00 0.00 57.70 56.29 1oyy n MET 127 Cb 0.26 -1.38 -0.04 0.00 0.00 0.00 0.00 33.22 32.05 1oyy n MET 127 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 1oyy s LEU 128 N -2.14 4.33 -1.31 4.03 1.43 -1.09 -4.60 118.68 119.32 1oyy s LEU 128 Ca 0.18 0.22 -0.01 0.00 -1.03 0.00 0.00 54.13 53.49 1oyy s LEU 128 Cb 0.16 -2.92 -0.00 0.00 0.03 0.00 0.00 46.19 43.46 1oyy s LEU 128 CO 0.44 0.13 0.66 -0.67 0.23 0.00 0.00 176.35 177.14 1oyy n ASP 129 N 0.03 -1.28 -4.12 2.29 2.03 -1.26 -2.70 116.55 111.55 1oyy n ASP 129 Ca -0.06 -0.86 -0.29 0.00 0.52 0.00 0.00 54.79 54.11 1oyy n ASP 129 Cb 0.52 -3.88 -0.05 0.00 -0.72 0.00 0.00 41.12 36.98 1oyy n ASP 129 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1oyy n ASN 130 N -3.03 0.05 -0.10 1.67 3.02 -1.26 -4.87 115.26 110.74 1oyy n ASN 130 Ca -0.29 -1.14 -0.13 0.00 -0.03 0.00 0.00 54.58 52.98 1oyy n ASN 130 Cb 0.68 -2.34 -0.04 0.00 -0.61 0.00 0.00 39.78 37.47 1oyy n ASN 130 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 1oyy h PHE 131 N -1.84 0.96 -0.56 3.10 3.57 -1.74 -3.12 116.94 117.30 1oyy h PHE 131 Ca -0.65 -0.30 0.06 0.00 3.53 0.00 0.00 57.97 60.61 1oyy h PHE 131 Cb 1.39 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 39.90 1oyy h PHE 131 CO 0.49 1.08 0.38 -0.07 -2.23 0.00 0.00 178.31 177.96 1oyy h LEU 132 N 0.57 0.47 -0.65 0.59 3.38 -1.89 0.29 115.31 118.07 1oyy h LEU 132 Ca 0.05 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 1oyy h LEU 132 Cb 0.93 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 1oyy h LEU 132 CO 0.08 0.31 -0.04 -0.08 0.09 0.00 0.00 178.44 178.80 1oyy h GLU 133 N 0.53 1.01 -0.03 1.13 4.57 -1.93 -0.31 114.58 119.55 1oyy h GLU 133 Ca 0.24 -0.33 -0.23 0.00 -1.18 0.00 0.00 59.36 57.86 1oyy h GLU 133 Cb 0.28 -0.09 0.01 0.00 -0.16 0.00 0.00 28.75 28.79 1oyy h GLU 133 CO -0.07 1.02 -0.90 0.45 -1.18 0.00 0.00 179.01 178.33 1oyy h HIS 134 N 0.92 0.74 0.00 0.92 3.86 -0.61 -3.07 115.15 117.90 1oyy h HIS 134 Ca 0.16 -0.38 -0.02 0.00 -1.16 0.00 0.00 60.37 58.97 1oyy h HIS 134 Cb 0.59 -0.09 -0.00 0.00 1.06 0.00 0.00 27.41 28.96 1oyy h HIS 134 CO 0.04 1.19 -0.10 1.25 0.86 0.00 0.00 177.93 181.17 1oyy h LEU 135 N 0.31 0.00 -1.22 2.43 5.85 -0.31 -1.31 115.31 121.07 1oyy h LEU 135 Ca -0.08 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1oyy h LEU 135 Cb 1.53 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.56 1oyy h LEU 135 CO 0.16 0.10 -0.03 0.00 -0.34 0.00 0.00 178.44 178.33 1oyy h ALA 136 N 1.90 1.00 -0.01 1.25 0.00 -0.96 -3.12 119.26 119.32 1oyy h ALA 136 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1oyy h ALA 136 Cb 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1oyy h ALA 136 CO 0.01 0.04 -0.26 0.72 0.00 0.00 0.00 179.25 179.76 1oyy n HIS 137 N -3.13 0.00 -1.01 0.00 8.25 -0.49 -4.46 115.22 114.37 1oyy n HIS 137 Ca 0.01 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.36 1oyy n HIS 137 Cb 0.35 -0.09 0.26 0.00 1.12 0.00 0.00 29.99 31.64 1oyy n HIS 137 CO 0.00 0.00 0.00 0.91 0.64 0.00 0.00 176.34 177.89 1oyy n TRP 138 N -0.44 2.57 -3.52 4.41 8.01 -1.18 -4.96 117.44 122.34 1oyy n TRP 138 Ca 0.12 -1.35 -0.19 0.00 -1.31 0.00 0.00 57.50 54.77 1oyy n TRP 138 Cb 0.37 -0.75 0.06 0.00 -2.01 0.00 0.00 31.31 28.98 1oyy n TRP 138 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.69 176.77 1oyy n ASN 139 N -0.39 -2.77 -4.65 -0.99 5.03 -1.26 -4.28 115.26 105.95 1oyy n ASN 139 Ca 0.45 -0.74 -0.43 0.00 0.87 0.00 0.00 54.58 54.73 1oyy n ASN 139 Cb 1.44 -4.62 -0.02 0.00 -1.02 0.00 0.00 39.78 35.56 1oyy n ASN 139 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 1oyy s PRO 140 N -5.46 4.13 -0.02 3.52 0.04 -1.26 -1.13 135.00 134.82 1oyy s PRO 140 Ca 0.12 1.28 0.20 0.00 0.04 0.00 0.00 61.00 62.64 1oyy s PRO 140 Cb -0.02 -3.73 -0.28 0.00 0.04 0.00 0.00 34.50 30.50 1oyy s PRO 140 CO 0.77 -0.82 0.59 1.55 0.04 0.00 0.00 177.00 179.14 1oyy n VAL 141 N 5.67 0.00 -3.64 -0.36 3.14 -0.31 -4.82 118.33 118.00 1oyy n VAL 141 Ca 0.13 -0.31 -0.04 0.00 -2.96 0.00 0.00 64.34 61.16 1oyy n VAL 141 Cb 0.46 0.39 -0.07 0.00 -1.06 0.00 0.00 33.84 33.56 1oyy n VAL 141 CO 0.00 0.00 0.00 -0.22 -6.46 0.00 0.00 176.83 170.15 1oyy s LEU 142 N -3.88 -0.61 -0.22 6.55 2.96 -1.21 -4.49 118.68 117.79 1oyy s LEU 142 Ca -0.02 0.99 -0.02 0.00 -0.22 0.00 0.00 54.13 54.86 1oyy s LEU 142 Cb 0.14 1.91 0.01 0.00 0.50 0.00 0.00 46.19 48.75 1oyy s LEU 142 CO 0.84 -0.16 -0.09 -0.22 -1.32 0.00 0.00 176.35 175.41 1oyy s LEU 143 N 1.31 2.85 -0.26 -0.68 0.20 -0.94 -0.56 118.68 120.60 1oyy s LEU 143 Ca -0.08 -0.65 -0.09 0.00 0.69 0.00 0.00 54.13 54.00 1oyy s LEU 143 Cb -0.04 -1.65 -0.04 0.00 -0.43 0.00 0.00 46.19 44.03 1oyy s LEU 143 CO -0.15 -0.06 0.12 0.00 -0.29 0.00 0.00 176.35 175.97 1oyy s ALA 144 N 1.37 3.33 -0.41 5.97 0.00 0.67 -1.13 121.76 131.55 1oyy s ALA 144 Ca 0.03 -1.09 -0.16 0.00 0.00 0.00 0.00 51.96 50.75 1oyy s ALA 144 Cb -0.15 -2.23 0.02 0.00 0.00 0.00 0.00 23.12 20.75 1oyy s ALA 144 CO -0.06 -0.47 0.35 0.08 0.00 0.00 0.00 175.76 175.65 1oyy s VAL 145 N 1.60 5.20 0.63 0.00 1.01 0.39 -1.94 120.40 127.29 1oyy s VAL 145 Ca 0.06 -0.51 -0.08 0.00 0.00 0.00 0.00 61.98 61.45 1oyy s VAL 145 Cb -0.15 -3.95 0.01 0.00 0.00 0.00 0.00 36.38 32.28 1oyy s VAL 145 CO 0.06 -0.33 0.97 -0.62 0.00 0.00 0.00 175.10 175.18 1oyy s ASP 146 N 1.73 5.52 -1.44 3.32 -1.08 -0.58 0.96 116.67 125.09 1oyy s ASP 146 Ca 0.08 0.84 -0.02 0.00 -0.52 0.00 0.00 52.55 52.92 1oyy s ASP 146 Cb -0.18 -1.76 0.00 0.00 -1.46 0.00 0.00 42.92 39.52 1oyy s ASP 146 CO 0.11 -1.17 0.28 -0.62 0.52 0.00 0.00 175.17 174.30 1oyy n GLU 147 N -2.73 -2.24 0.00 4.34 4.71 -1.03 -4.77 120.64 118.91 1oyy n GLU 147 Ca 0.05 0.28 0.14 0.00 -0.01 0.00 0.00 57.16 57.62 1oyy n GLU 147 Cb 0.58 -4.09 0.62 0.00 -1.01 0.00 0.00 31.44 27.53 1oyy n GLU 147 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1oyy n ALA 148 N -4.49 2.61 0.24 0.62 0.00 -0.37 -1.95 120.51 117.17 1oyy n ALA 148 Ca -0.30 -0.18 0.12 0.00 0.00 0.00 0.00 53.44 53.08 1oyy n ALA 148 Cb 0.68 -1.41 0.56 0.00 0.00 0.00 0.00 19.45 19.28 1oyy n ALA 148 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 1oyy h HIS 149 N 0.12 0.00 0.00 0.00 2.07 -1.86 -3.15 115.15 112.33 1oyy h HIS 149 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1oyy h HIS 149 Cb 0.41 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.39 1oyy h HIS 149 CO 0.00 0.16 0.31 0.00 -3.07 0.00 0.00 177.93 175.33 1oyy n ILE 151 N -2.20 0.04 -3.84 0.00 3.06 -1.19 -0.39 119.36 114.84 1oyy n ILE 151 Ca -0.01 -0.02 -0.35 0.00 -2.50 0.00 0.00 62.75 59.87 1oyy n ILE 151 Cb 0.34 -0.10 -0.08 0.00 0.54 0.00 0.00 39.64 40.33 1oyy n ILE 151 CO 0.00 0.00 0.00 -0.55 -2.50 0.00 0.00 176.55 173.50 1oyy s SER 152 N -3.12 6.01 0.46 9.51 0.15 0.56 -4.83 113.70 122.45 1oyy s SER 152 Ca 0.12 0.19 0.14 0.00 0.70 0.00 0.00 55.95 57.10 1oyy s SER 152 Cb 0.18 -2.04 1.06 0.00 -1.71 0.00 0.00 66.02 63.50 1oyy s SER 152 CO 0.63 0.19 2.04 0.06 1.20 0.00 0.00 173.24 177.36 1oyy h GLN 153 N 6.58 0.05 0.00 5.44 3.07 -1.88 -1.97 115.11 126.39 1oyy h GLN 153 Ca -0.40 -0.01 0.00 0.00 0.09 0.00 0.00 58.65 58.33 1oyy h GLN 153 Cb 1.16 -0.01 0.00 0.00 0.08 0.00 0.00 27.48 28.71 1oyy h GLN 153 CO 0.73 0.15 0.00 0.91 0.09 0.00 0.00 178.83 180.71 1oyy n TRP 154 N -4.39 0.00 -1.08 0.06 7.02 -1.26 -4.84 117.44 112.94 1oyy n TRP 154 Ca -0.02 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.46 1oyy n TRP 154 Cb 0.19 -0.48 0.00 0.00 -2.42 0.00 0.00 31.31 28.60 1oyy n TRP 154 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1oyy n GLY 155 N 0.63 -0.53 1.19 6.99 0.00 -0.74 -4.79 105.19 107.94 1oyy n GLY 155 Ca 0.05 -1.73 0.12 0.00 0.00 0.00 0.00 46.02 44.46 1oyy n GLY 155 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1oyy n HIS 156 N -1.36 0.62 -2.73 1.61 1.44 -1.26 -4.53 115.22 109.01 1oyy n HIS 156 Ca 0.00 -0.31 -0.08 0.00 -2.01 0.00 0.00 57.72 55.32 1oyy n HIS 156 Cb 0.00 0.00 0.09 0.00 0.12 0.00 0.00 29.99 30.20 1oyy n HIS 156 CO 0.00 0.00 0.00 -3.47 -2.81 0.00 0.00 176.34 170.06 1oyy n ASP 157 N 1.49 -1.26 -4.70 4.39 2.03 -1.26 -5.02 116.55 112.21 1oyy n ASP 157 Ca 0.21 -2.77 -0.42 0.00 0.52 0.00 0.00 54.79 52.33 1oyy n ASP 157 Cb 0.60 0.84 -0.03 0.00 -0.72 0.00 0.00 41.12 41.80 1oyy n ASP 157 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 1oyy n PHE 158 N -0.28 2.70 -4.84 -0.67 7.35 -1.26 -4.36 117.46 116.10 1oyy n PHE 158 Ca 0.02 -0.06 -0.29 0.00 -0.76 0.00 0.00 57.45 56.36 1oyy n PHE 158 Cb 0.81 -2.71 -0.17 0.00 0.35 0.00 0.00 39.48 37.76 1oyy n PHE 158 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 1oyy s ARG 159 N 1.95 2.47 0.40 -4.13 0.52 0.48 -5.03 118.95 115.61 1oyy s ARG 159 Ca 0.78 -0.67 0.11 0.00 -0.52 0.00 0.00 55.73 55.43 1oyy s ARG 159 Cb -0.49 -1.96 0.85 0.00 0.52 0.00 0.00 34.95 33.87 1oyy s ARG 159 CO 0.35 0.07 1.94 -1.00 0.02 0.00 0.00 175.30 176.68 1oyy h PRO 160 N 6.97 0.17 0.00 3.54 0.13 -1.94 -3.16 132.00 137.71 1oyy h PRO 160 Ca -0.26 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1oyy h PRO 160 Cb 1.21 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1oyy h PRO 160 CO 0.48 0.32 0.00 1.05 -0.23 0.00 0.00 178.00 179.62 1oyy h GLU 161 N 0.16 0.00 0.00 0.86 9.09 -1.95 -0.55 114.58 122.19 1oyy h GLU 161 Ca 0.03 0.00 -0.19 0.00 0.05 0.00 0.00 59.36 59.25 1oyy h GLU 161 Cb 0.36 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.43 1oyy h GLU 161 CO 0.02 0.00 -0.94 1.88 0.05 0.00 0.00 179.01 180.03 1oyy h TYR 162 N 0.00 0.00 -0.92 2.06 0.99 -1.87 -3.34 116.97 113.89 1oyy h TYR 162 Ca 0.00 0.00 0.12 0.00 2.00 0.00 0.00 58.73 60.85 1oyy h TYR 162 Cb 0.49 0.00 -0.13 0.00 1.00 0.00 0.00 36.73 38.08 1oyy h TYR 162 CO 0.00 0.89 -0.43 0.00 -0.00 0.00 0.00 178.16 178.62 1oyy n ALA 163 N -2.33 -0.29 0.20 3.88 0.00 -0.22 -0.62 120.51 121.13 1oyy n ALA 163 Ca -0.01 0.86 0.10 0.00 0.00 0.00 0.00 53.44 54.40 1oyy n ALA 163 Cb 0.90 -0.30 0.52 0.00 0.00 0.00 0.00 19.45 20.57 1oyy n ALA 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1oyy n ALA 164 N -3.44 1.16 0.20 0.00 0.00 -1.25 -1.42 120.51 115.76 1oyy n ALA 164 Ca 0.07 0.16 0.11 0.00 0.00 0.00 0.00 53.44 53.78 1oyy n ALA 164 Cb 0.32 -1.30 0.60 0.00 0.00 0.00 0.00 19.45 19.07 1oyy n ALA 164 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1oyy h LEU 165 N 0.00 0.00 0.00 0.00 3.38 -1.08 0.49 115.31 118.10 1oyy h LEU 165 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1oyy h LEU 165 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1oyy h LEU 165 CO 0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 1oyy n GLY 166 N -1.26 -0.88 0.12 0.83 0.00 -0.50 -2.87 105.19 100.63 1oyy n GLY 166 Ca -0.01 -0.15 0.10 0.00 0.00 0.00 0.00 46.02 45.96 1oyy n GLY 166 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1oyy h GLN 167 N 0.00 0.00 -0.47 1.61 4.20 -1.15 -3.39 115.11 115.91 1oyy h GLN 167 Ca 0.00 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.64 1oyy h GLN 167 Cb 0.07 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.83 1oyy h GLN 167 CO 0.00 0.05 -0.01 -0.07 -0.67 0.00 0.00 178.83 178.12 1oyy h LEU 168 N 0.00 0.76 -0.00 1.46 3.38 -1.72 -1.99 115.31 117.20 1oyy h LEU 168 Ca -0.02 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.76 1oyy h LEU 168 Cb 1.08 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.63 1oyy h LEU 168 CO 0.01 0.83 0.00 0.08 0.09 0.00 0.00 178.44 179.45 1oyy h ARG 169 N 0.73 0.00 -0.29 1.13 0.11 -1.79 0.59 114.38 114.86 1oyy h ARG 169 Ca 0.14 -0.00 0.06 0.00 0.10 0.00 0.00 59.98 60.28 1oyy h ARG 169 Cb 0.46 -0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.49 1oyy h ARG 169 CO 0.02 0.10 -0.04 1.96 0.10 0.00 0.00 179.97 182.10 1oyy h GLN 170 N -0.09 0.03 -0.56 0.08 1.08 -1.69 -0.68 115.11 113.29 1oyy h GLN 170 Ca 0.00 -0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.13 1oyy h GLN 170 Cb 0.10 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.49 1oyy h GLN 170 CO -0.00 0.02 0.06 -0.09 -0.95 0.00 0.00 178.83 177.87 1oyy h ARG 171 N 0.03 0.91 -2.99 1.46 9.65 -1.17 -3.38 114.38 118.90 1oyy h ARG 171 Ca 0.14 -0.23 -0.62 0.00 -1.10 0.00 0.00 59.98 58.17 1oyy h ARG 171 Cb 0.20 -0.11 -0.41 0.00 -1.39 0.00 0.00 29.97 28.26 1oyy h ARG 171 CO -0.27 0.87 -0.62 -0.06 2.80 0.00 0.00 179.97 182.68 1oyy s PHE 172 N -5.10 3.26 0.12 2.20 0.08 0.20 -4.95 117.98 113.80 1oyy s PHE 172 Ca -0.10 -3.22 0.19 0.00 0.12 0.00 0.00 56.93 53.92 1oyy s PHE 172 Cb 0.15 -2.48 0.63 0.00 -0.57 0.00 0.00 43.02 40.75 1oyy s PHE 172 CO 0.82 -0.58 1.71 -1.00 -0.10 0.00 0.00 175.22 176.07 1oyy h PRO 173 N 5.41 0.00 -0.28 0.24 0.13 -1.70 -2.78 132.00 133.02 1oyy h PRO 173 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1oyy h PRO 173 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 1oyy h PRO 173 CO 0.67 0.37 0.00 0.25 -0.23 0.00 0.00 178.00 179.07 1oyy n THR 174 N -3.47 0.34 -2.70 1.56 -2.24 -1.26 -4.90 114.28 101.62 1oyy n THR 174 Ca 0.00 -0.65 -0.43 0.00 -2.27 0.00 0.00 64.05 60.71 1oyy n THR 174 Cb 0.53 1.07 -0.03 0.00 -2.10 0.00 0.00 70.33 69.80 1oyy n THR 174 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1oyy s LEU 175 N -1.64 3.75 0.33 3.22 2.96 -1.05 -5.01 118.68 121.24 1oyy s LEU 175 Ca 0.36 -0.01 -0.29 0.00 -0.22 0.00 0.00 54.13 53.98 1oyy s LEU 175 Cb 0.22 -3.10 -0.12 0.00 0.50 0.00 0.00 46.19 43.69 1oyy s LEU 175 CO 0.31 -1.32 1.33 -2.65 -1.32 0.00 0.00 176.35 172.70 1oyy n PRO 176 N 7.90 2.17 -4.35 0.98 -0.02 -1.26 -4.86 135.00 135.56 1oyy n PRO 176 Ca 0.06 0.76 -0.27 0.00 -2.02 0.00 0.00 63.50 62.04 1oyy n PRO 176 Cb 0.48 -2.37 -0.13 0.00 -0.02 0.00 0.00 33.50 31.47 1oyy n PRO 176 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1oyy s PHE 177 N -0.89 2.07 0.02 6.00 0.40 -1.26 -2.21 117.98 122.10 1oyy s PHE 177 Ca 0.58 -0.40 0.03 0.00 -0.60 0.00 0.00 56.93 56.54 1oyy s PHE 177 Cb -0.57 -1.13 -0.01 0.00 0.51 0.00 0.00 43.02 41.82 1oyy s PHE 177 CO 0.60 0.27 -0.10 0.00 0.70 0.00 0.00 175.22 176.70 1oyy s MET 178 N -1.97 0.70 -0.20 0.44 0.23 -0.29 -0.91 119.30 117.30 1oyy s MET 178 Ca 0.10 -0.53 0.01 0.00 -1.03 0.00 0.00 55.69 54.25 1oyy s MET 178 Cb -0.10 -0.64 0.03 0.00 -1.53 0.00 0.00 34.83 32.58 1oyy s MET 178 CO 0.05 0.16 -0.18 0.00 -2.03 0.00 0.00 175.02 173.03 1oyy s ALA 179 N -0.64 2.36 -0.02 3.16 0.00 0.12 0.15 121.76 126.88 1oyy s ALA 179 Ca -0.00 -1.32 0.04 0.00 0.00 0.00 0.00 51.96 50.68 1oyy s ALA 179 Cb -0.06 -1.26 -0.03 0.00 0.00 0.00 0.00 23.12 21.77 1oyy s ALA 179 CO 0.00 -0.54 -0.14 -0.51 0.00 0.00 0.00 175.76 174.57 1oyy s LEU 180 N 1.26 2.79 0.02 0.00 1.02 0.27 -2.25 118.68 121.78 1oyy s LEU 180 Ca 0.02 -0.24 -0.26 0.00 0.02 0.00 0.00 54.13 53.67 1oyy s LEU 180 Cb -0.15 -1.59 0.06 0.00 0.02 0.00 0.00 46.19 44.53 1oyy s LEU 180 CO -0.11 0.31 0.60 0.28 0.02 0.00 0.00 176.35 177.45 1oyy s THR 181 N -0.82 0.01 -0.46 5.49 -1.32 -0.68 -1.24 115.64 116.61 1oyy s THR 181 Ca 0.13 -0.10 0.09 0.00 -1.21 0.00 0.00 61.69 60.61 1oyy s THR 181 Cb -0.11 -0.97 -0.10 0.00 -1.51 0.00 0.00 72.50 69.81 1oyy s THR 181 CO 0.03 -0.05 0.41 0.00 -2.21 0.00 0.00 174.62 172.80 1oyy n ALA 182 N 0.55 3.22 -3.52 11.08 0.00 -1.25 -2.27 120.51 128.32 1oyy n ALA 182 Ca -0.19 -0.27 -0.27 0.00 0.00 0.00 0.00 53.44 52.71 1oyy n ALA 182 Cb 0.59 -0.34 -0.11 0.00 0.00 0.00 0.00 19.45 19.59 1oyy n ALA 182 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1oyy s THR 183 N -1.87 0.97 -0.22 0.00 2.01 -1.26 -4.51 115.64 110.76 1oyy s THR 183 Ca 0.04 -3.06 -0.08 0.00 0.31 0.00 0.00 61.69 58.89 1oyy s THR 183 Cb 0.07 -1.66 0.10 0.00 0.01 0.00 0.00 72.50 71.01 1oyy s THR 183 CO 0.38 -1.18 0.48 0.00 -0.69 0.00 0.00 174.62 173.62 1oyy s ALA 184 N -0.33 -1.39 1.17 7.40 0.00 -1.26 -4.90 121.76 122.45 1oyy s ALA 184 Ca 0.31 1.74 -0.12 0.00 0.00 0.00 0.00 51.96 53.89 1oyy s ALA 184 Cb 0.02 -1.40 0.18 0.00 0.00 0.00 0.00 23.12 21.92 1oyy s ALA 184 CO -0.19 -0.74 0.59 -0.40 0.00 0.00 0.00 175.76 175.02 1oyy n ASP 185 N 5.27 -1.96 0.19 0.00 5.75 -1.26 -4.60 116.55 119.94 1oyy n ASP 185 Ca -0.11 -0.80 -0.15 0.00 -0.01 0.00 0.00 54.79 53.73 1oyy n ASP 185 Cb 0.50 -0.57 -0.07 0.00 -1.03 0.00 0.00 41.12 39.95 1oyy n ASP 185 CO 0.00 0.00 0.00 -0.78 -0.11 0.00 0.00 177.20 176.31 1oyy h ASP 186 N -2.18 -0.53 -0.50 -1.12 3.58 -1.85 -1.37 116.42 112.45 1oyy h ASP 186 Ca -0.23 0.04 0.09 0.00 0.42 0.00 0.00 57.03 57.34 1oyy h ASP 186 Cb 0.72 0.16 -0.10 0.00 1.72 0.00 0.00 39.33 41.83 1oyy h ASP 186 CO 0.15 -0.33 -0.37 0.74 -2.88 0.00 0.00 179.24 176.55 1oyy h THR 187 N -0.51 0.15 -0.70 2.25 2.02 -1.96 -0.59 112.91 113.58 1oyy h THR 187 Ca -0.03 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.11 1oyy h THR 187 Cb 0.43 0.15 -0.03 0.00 -1.74 0.00 0.00 68.15 66.96 1oyy h THR 187 CO 0.01 0.00 0.25 0.74 0.37 0.00 0.00 175.52 176.90 1oyy h THR 188 N -0.23 1.25 0.30 3.16 2.02 -1.85 0.21 112.91 117.75 1oyy h THR 188 Ca 0.19 -0.81 -0.01 0.00 0.77 0.00 0.00 66.41 66.54 1oyy h THR 188 Cb 0.56 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 67.41 1oyy h THR 188 CO -0.63 0.32 -0.14 0.03 0.37 0.00 0.00 175.52 175.47 1oyy h ARG 189 N 1.03 -0.39 -0.49 6.66 3.08 -0.61 0.10 114.38 123.77 1oyy h ARG 189 Ca 0.23 0.03 0.08 0.00 0.07 0.00 0.00 59.98 60.39 1oyy h ARG 189 Cb 0.24 0.09 -0.07 0.00 0.08 0.00 0.00 29.97 30.31 1oyy h ARG 189 CO -0.01 -0.17 0.08 1.96 -1.07 0.00 0.00 179.97 180.76 1oyy h GLN 190 N -0.54 0.21 -0.45 0.04 4.20 -0.95 0.08 115.11 117.70 1oyy h GLN 190 Ca -0.04 -0.01 -0.07 0.00 0.06 0.00 0.00 58.65 58.58 1oyy h GLN 190 Cb 0.40 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.11 1oyy h GLN 190 CO 0.07 0.14 -0.02 0.22 -0.67 0.00 0.00 178.83 178.57 1oyy h ASP 191 N 0.22 0.71 -0.27 1.46 3.58 -0.34 -2.58 116.42 119.20 1oyy h ASP 191 Ca 0.24 -0.17 0.05 0.00 0.42 0.00 0.00 57.03 57.57 1oyy h ASP 191 Cb 0.33 -0.19 -0.05 0.00 1.72 0.00 0.00 39.33 41.14 1oyy h ASP 191 CO -0.33 0.79 -0.05 0.40 -2.88 0.00 0.00 179.24 177.17 1oyy h ILE 192 N 0.69 0.74 -0.41 2.25 2.04 0.13 -0.07 117.51 122.88 1oyy h ILE 192 Ca 0.13 -0.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.98 1oyy h ILE 192 Cb 0.46 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 1oyy h ILE 192 CO 0.02 0.00 0.22 0.58 0.00 0.00 0.00 178.15 178.97 1oyy h VAL 193 N 0.02 1.16 0.07 1.67 2.07 -1.35 -0.75 116.25 119.13 1oyy h VAL 193 Ca 0.13 -0.43 -0.00 0.00 0.82 0.00 0.00 66.70 67.22 1oyy h VAL 193 Cb 0.19 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 30.65 1oyy h VAL 193 CO -0.27 0.17 -0.03 -0.09 0.02 0.00 0.00 177.57 177.37 1oyy h ARG 194 N 0.53 -0.09 0.00 1.57 2.43 -1.13 -2.37 114.38 115.33 1oyy h ARG 194 Ca 0.14 0.01 -0.14 0.00 -0.81 0.00 0.00 59.98 59.18 1oyy h ARG 194 Cb 0.08 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.63 1oyy h ARG 194 CO -0.02 -0.06 -0.67 -0.07 -1.51 0.00 0.00 179.97 177.64 1oyy h LEU 195 N -0.10 0.00 0.00 3.80 3.38 -0.22 -2.74 115.31 119.43 1oyy h LEU 195 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1oyy h LEU 195 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1oyy h LEU 195 CO 0.02 0.67 -0.51 0.18 0.09 0.00 0.00 178.44 178.88 1oyy n LEU 196 N -3.55 0.71 -2.64 1.67 4.77 -0.36 -4.40 117.00 113.20 1oyy n LEU 196 Ca -0.00 0.28 -0.11 0.00 -0.03 0.00 0.00 56.01 56.15 1oyy n LEU 196 Cb 0.70 -0.21 0.05 0.00 -2.33 0.00 0.00 43.42 41.64 1oyy n LEU 196 CO 0.42 -0.07 0.05 0.61 -1.33 0.00 0.00 177.39 177.07 1oyy n GLY 197 N 1.34 -0.27 3.74 -0.72 0.00 -0.92 -4.58 105.19 103.77 1oyy n GLY 197 Ca 0.04 0.09 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1oyy n GLY 197 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1oyy s LEU 198 N -4.77 4.42 -0.53 0.99 1.43 -1.03 -4.96 118.68 114.23 1oyy s LEU 198 Ca 0.14 2.38 -0.20 0.00 -1.03 0.00 0.00 54.13 55.42 1oyy s LEU 198 Cb -0.02 -3.61 0.06 0.00 0.03 0.00 0.00 46.19 42.65 1oyy s LEU 198 CO 0.49 -0.51 0.72 0.21 0.23 0.00 0.00 176.35 177.49 1oyy s ASN 199 N 0.32 6.24 -0.77 2.29 2.47 -1.26 -4.57 114.94 119.65 1oyy s ASN 199 Ca 0.56 -0.86 -0.10 0.00 0.42 0.00 0.00 52.86 52.88 1oyy s ASN 199 Cb -0.36 -2.33 0.01 0.00 -1.45 0.00 0.00 41.25 37.12 1oyy s ASN 199 CO 0.38 -1.02 0.50 -0.67 -3.72 0.00 0.00 177.10 172.57 1oyy n ASP 200 N 6.55 -3.66 -4.88 -4.21 2.03 -1.26 -4.50 116.55 106.61 1oyy n ASP 200 Ca -0.05 -0.89 -0.30 0.00 0.52 0.00 0.00 54.79 54.08 1oyy n ASP 200 Cb 0.45 -1.28 -0.00 0.00 -0.72 0.00 0.00 41.12 39.57 1oyy n ASP 200 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1oyy s PRO 201 N -5.28 3.64 -0.20 -0.67 0.04 -1.26 -4.81 135.00 126.46 1oyy s PRO 201 Ca 0.13 0.57 -0.29 0.00 0.04 0.00 0.00 61.00 61.45 1oyy s PRO 201 Cb -0.07 -2.21 -0.01 0.00 0.04 0.00 0.00 34.50 32.24 1oyy s PRO 201 CO 0.75 -0.36 1.27 -1.17 0.04 0.00 0.00 177.00 177.52 1oyy s LEU 202 N -4.78 4.11 -0.52 -3.56 0.20 -0.59 -4.89 118.68 108.66 1oyy s LEU 202 Ca 0.53 1.57 -0.16 0.00 0.69 0.00 0.00 54.13 56.76 1oyy s LEU 202 Cb -0.11 -3.54 0.10 0.00 -0.43 0.00 0.00 46.19 42.22 1oyy s LEU 202 CO 0.46 -0.84 0.48 -0.63 -0.29 0.00 0.00 176.35 175.53 1oyy s ILE 203 N 3.72 5.18 -0.29 6.68 1.01 -1.26 -1.63 121.20 134.61 1oyy s ILE 203 Ca 0.55 -1.27 -0.11 0.00 0.00 0.00 0.00 60.65 59.83 1oyy s ILE 203 Cb -0.20 -4.27 -0.04 0.00 0.01 0.00 0.00 42.46 37.96 1oyy s ILE 203 CO 0.16 -0.77 0.18 -1.58 0.00 0.00 0.00 174.94 172.93 1oyy s GLN 204 N 1.72 3.77 -0.53 2.79 0.74 -0.40 -5.02 119.66 122.73 1oyy s GLN 204 Ca 0.04 -0.44 -0.00 0.00 0.05 0.00 0.00 55.36 55.01 1oyy s GLN 204 Cb -0.27 -3.64 0.14 0.00 1.10 0.00 0.00 33.01 30.33 1oyy s GLN 204 CO 0.05 -0.26 0.31 0.42 -0.55 0.00 0.00 175.29 175.26 1oyy s ILE 205 N 1.72 3.18 1.38 -2.34 1.01 -1.26 -1.33 121.20 123.57 1oyy s ILE 205 Ca 0.07 -2.83 -0.21 0.00 0.00 0.00 0.00 60.65 57.67 1oyy s ILE 205 Cb -0.16 -3.15 0.35 0.00 0.01 0.00 0.00 42.46 39.51 1oyy s ILE 205 CO 0.10 -0.79 0.82 -1.20 0.00 0.00 0.00 174.94 173.86 1oyy n SER 206 N 3.66 -3.69 -4.83 3.58 7.64 0.13 -4.97 113.62 115.15 1oyy n SER 206 Ca 0.05 -0.71 -0.31 0.00 1.01 0.00 0.00 58.87 58.91 1oyy n SER 206 Cb 0.37 -1.02 0.03 0.00 -1.01 0.00 0.00 64.21 62.59 1oyy n SER 206 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1oyy s SER 207 N -2.83 5.71 0.00 6.43 0.15 -1.26 -4.80 113.70 117.09 1oyy s SER 207 Ca 0.64 1.60 0.21 0.00 0.70 0.00 0.00 55.95 59.11 1oyy s SER 207 Cb -0.14 -2.50 0.04 0.00 -1.71 0.00 0.00 66.02 61.72 1oyy s SER 207 CO 0.56 -1.22 1.08 0.49 1.20 0.00 0.00 173.24 175.34 1oyy n PHE 208 N -2.78 0.00 -2.05 3.44 3.01 -1.26 -4.27 117.46 113.56 1oyy n PHE 208 Ca 0.07 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.11 1oyy n PHE 208 Cb 0.54 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.98 1oyy n PHE 208 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1oyy s ASP 209 N -2.23 6.70 -0.78 4.37 -1.08 -1.26 -4.87 116.67 117.52 1oyy s ASP 209 Ca 0.20 2.43 -0.16 0.00 -0.52 0.00 0.00 52.55 54.49 1oyy s ASP 209 Cb 0.17 -2.58 0.17 0.00 -1.46 0.00 0.00 42.92 39.22 1oyy s ASP 209 CO 0.47 -0.77 0.82 -0.13 0.52 0.00 0.00 175.17 176.08 1oyy s ARG 210 N 1.62 3.43 0.57 4.34 1.81 -1.26 -4.97 118.95 124.50 1oyy s ARG 210 Ca 0.68 -1.99 0.33 0.00 -1.72 0.00 0.00 55.73 53.04 1oyy s ARG 210 Cb -0.39 -4.50 1.74 0.00 -0.45 0.00 0.00 34.95 31.35 1oyy s ARG 210 CO 0.30 -1.46 2.16 -1.00 -0.68 0.00 0.00 175.30 174.62 1oyy h PRO 211 N 8.43 0.00 -0.00 3.54 0.13 -1.98 -1.89 132.00 140.23 1oyy h PRO 211 Ca -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1oyy h PRO 211 Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1oyy h PRO 211 CO 0.94 0.05 -0.02 0.27 -0.23 0.00 0.00 178.00 179.01 1oyy n ASN 212 N -3.44 0.04 -4.69 1.44 6.94 -1.26 -4.69 115.26 109.59 1oyy n ASN 212 Ca -0.02 0.04 -0.39 0.00 -0.02 0.00 0.00 54.58 54.19 1oyy n ASN 212 Cb 0.18 -0.33 -0.06 0.00 -2.36 0.00 0.00 39.78 37.21 1oyy n ASN 212 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1oyy s ILE 213 N -2.72 5.12 -0.21 1.53 1.01 -0.71 0.36 121.20 125.58 1oyy s ILE 213 Ca 0.23 1.06 -0.17 0.00 0.00 0.00 0.00 60.65 61.78 1oyy s ILE 213 Cb 0.20 -3.88 -0.04 0.00 0.01 0.00 0.00 42.46 38.75 1oyy s ILE 213 CO 0.49 0.24 0.45 -0.60 0.00 0.00 0.00 174.94 175.52 1oyy s ARG 214 N 1.15 4.16 -0.16 2.79 3.52 -0.15 -4.94 118.95 125.31 1oyy s ARG 214 Ca 0.28 0.28 -0.19 0.00 -0.13 0.00 0.00 55.73 55.96 1oyy s ARG 214 Cb -0.16 -3.57 -0.03 0.00 -1.56 0.00 0.00 34.95 29.63 1oyy s ARG 214 CO 0.11 -0.13 0.54 0.71 -0.81 0.00 0.00 175.30 175.72 1oyy s TYR 215 N 1.59 3.44 0.17 5.12 2.02 -1.15 -1.73 117.35 126.81 1oyy s TYR 215 Ca 0.21 0.89 0.06 0.00 -0.37 0.00 0.00 57.07 57.86 1oyy s TYR 215 Cb -0.15 -2.66 -0.04 0.00 -0.40 0.00 0.00 41.96 38.70 1oyy s TYR 215 CO 0.09 0.00 -0.13 -1.64 -1.57 0.00 0.00 175.55 172.30 1oyy s MET 216 N 1.24 1.18 0.05 -0.62 -1.94 -0.20 -0.92 119.30 118.09 1oyy s MET 216 Ca 0.27 -1.47 0.02 0.00 -1.71 0.00 0.00 55.69 52.79 1oyy s MET 216 Cb -0.16 -0.93 -0.03 0.00 2.01 0.00 0.00 34.83 35.72 1oyy s MET 216 CO 0.11 0.15 -0.07 -1.17 -0.01 0.00 0.00 175.02 174.03 1oyy s LEU 217 N -3.08 2.32 -0.03 -0.03 0.20 -1.26 -0.19 118.68 116.61 1oyy s LEU 217 Ca 0.18 -0.66 0.01 0.00 0.69 0.00 0.00 54.13 54.36 1oyy s LEU 217 Cb -0.01 -0.09 0.01 0.00 -0.43 0.00 0.00 46.19 45.67 1oyy s LEU 217 CO 0.04 -0.29 -0.05 -0.32 -0.29 0.00 0.00 176.35 175.44 1oyy s MET 218 N -2.12 0.73 -0.07 1.98 -2.45 -0.05 -4.87 119.30 112.45 1oyy s MET 218 Ca -0.06 -0.16 -0.27 0.00 -1.25 0.00 0.00 55.69 53.95 1oyy s MET 218 Cb -0.06 -0.72 -0.03 0.00 1.25 0.00 0.00 34.83 35.27 1oyy s MET 218 CO -0.01 0.00 0.89 -1.21 1.05 0.00 0.00 175.02 175.74 1oyy s GLU 219 N 0.52 4.45 0.71 4.11 2.02 -1.26 -1.65 118.70 127.61 1oyy s GLU 219 Ca -0.07 1.21 -0.16 0.00 0.02 0.00 0.00 54.97 55.97 1oyy s GLU 219 Cb -0.10 -3.49 0.02 0.00 0.10 0.00 0.00 34.13 30.65 1oyy s GLU 219 CO 0.00 -0.13 1.18 1.63 0.02 0.00 0.00 175.26 177.96 1oyy n LYS 220 N 4.34 0.67 0.00 1.61 5.02 0.53 -4.84 118.16 125.49 1oyy n LYS 220 Ca 0.05 0.29 0.00 0.00 -2.02 0.00 0.00 58.31 56.63 1oyy n LYS 220 Cb 0.50 -2.42 0.00 0.00 -0.02 0.00 0.00 35.03 33.09 1oyy n LYS 220 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1oyy n PHE 221 N -2.49 0.00 -3.32 2.13 7.35 -1.26 -4.91 117.46 114.96 1oyy n PHE 221 Ca 0.14 0.00 -0.16 0.00 -0.76 0.00 0.00 57.45 56.67 1oyy n PHE 221 Cb 0.49 0.00 0.07 0.00 0.35 0.00 0.00 39.48 40.40 1oyy n PHE 221 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 1oyy n LYS 222 N 0.00 -3.59 -0.36 -4.13 5.02 -1.26 -4.56 118.16 109.28 1oyy n LYS 222 Ca 0.00 0.85 0.03 0.00 -2.02 0.00 0.00 58.31 57.17 1oyy n LYS 222 Cb 0.00 -5.80 0.19 0.00 -0.02 0.00 0.00 35.03 29.39 1oyy n LYS 222 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1oyy h PRO 223 N -1.36 1.12 -0.83 1.97 0.13 -1.95 -0.69 132.00 130.39 1oyy h PRO 223 Ca -0.61 -0.07 -0.00 0.00 -0.87 0.00 0.00 66.00 64.46 1oyy h PRO 223 Cb 1.32 -0.25 -0.04 0.00 0.13 0.00 0.00 31.00 32.16 1oyy h PRO 223 CO 0.46 0.74 0.51 -0.07 -0.23 0.00 0.00 178.00 179.41 1oyy h LEU 224 N 1.15 0.98 -0.43 1.56 3.38 -1.98 1.61 115.31 121.57 1oyy h LEU 224 Ca 0.42 -0.05 -0.09 0.00 0.09 0.00 0.00 57.88 58.25 1oyy h LEU 224 Cb 0.16 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1oyy h LEU 224 CO -0.16 0.75 -0.08 0.44 0.09 0.00 0.00 178.44 179.47 1oyy h ASP 225 N 1.13 0.83 -0.91 -0.43 3.32 -1.59 -1.39 116.42 117.38 1oyy h ASP 225 Ca 0.30 -0.35 0.02 0.00 0.02 0.00 0.00 57.03 57.01 1oyy h ASP 225 Cb -0.07 -0.22 -0.05 0.00 0.22 0.00 0.00 39.33 39.21 1oyy h ASP 225 CO -0.06 0.99 0.60 1.56 -1.72 0.00 0.00 179.24 180.61 1oyy h GLN 226 N 0.65 1.17 -0.29 3.56 4.20 -0.11 0.26 115.11 124.56 1oyy h GLN 226 Ca 0.11 -0.07 -0.08 0.00 0.06 0.00 0.00 58.65 58.67 1oyy h GLN 226 Cb 0.61 -0.26 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 1oyy h GLN 226 CO 0.04 0.78 -0.15 1.25 -0.67 0.00 0.00 178.83 180.08 1oyy h LEU 227 N 1.21 0.63 -0.64 1.46 5.85 0.29 -1.42 115.31 122.69 1oyy h LEU 227 Ca 0.34 -0.41 0.02 0.00 0.84 0.00 0.00 57.88 58.68 1oyy h LEU 227 Cb -0.10 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.72 1oyy h LEU 227 CO -0.09 0.90 0.40 0.24 -0.34 0.00 0.00 178.44 179.56 1oyy h MET 228 N 0.36 0.77 -0.46 1.25 2.86 -0.52 -2.25 114.93 116.94 1oyy h MET 228 Ca 0.06 -0.05 -0.10 0.00 -2.06 0.00 0.00 59.70 57.55 1oyy h MET 228 Cb 0.67 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 1oyy h MET 228 CO 0.04 0.51 -0.12 -0.09 1.06 0.00 0.00 176.91 178.32 1oyy h ARG 229 N 0.80 0.89 -0.41 1.72 2.43 -0.41 -2.19 114.38 117.20 1oyy h ARG 229 Ca 0.25 -0.34 0.08 0.00 -0.81 0.00 0.00 59.98 59.15 1oyy h ARG 229 Cb -0.01 -0.05 -0.09 0.00 -0.42 0.00 0.00 29.97 29.40 1oyy h ARG 229 CO -0.09 0.99 -0.38 -0.92 -1.51 0.00 0.00 179.97 178.06 1oyy h TYR 230 N 0.73 -1.08 0.35 2.20 3.20 -1.18 -0.06 116.97 121.12 1oyy h TYR 230 Ca 0.12 0.06 -0.02 0.00 3.14 0.00 0.00 58.73 62.03 1oyy h TYR 230 Cb 0.66 0.53 0.00 0.00 1.54 0.00 0.00 36.73 39.47 1oyy h TYR 230 CO 0.05 -0.41 -0.17 0.28 -1.64 0.00 0.00 178.16 176.27 1oyy h VAL 231 N -0.29 0.66 -0.97 1.81 2.07 -1.27 -2.58 116.25 115.68 1oyy h VAL 231 Ca 0.16 -0.14 0.14 0.00 0.82 0.00 0.00 66.70 67.68 1oyy h VAL 231 Cb 0.57 0.74 -0.15 0.00 -1.52 0.00 0.00 31.29 30.93 1oyy h VAL 231 CO -0.57 0.03 -0.42 1.56 0.02 0.00 0.00 177.57 178.19 1oyy h GLN 232 N -0.55 -0.01 0.00 1.57 1.08 -1.38 -0.90 115.11 114.91 1oyy h GLN 232 Ca -0.05 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.15 1oyy h GLN 232 Cb 0.41 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.84 1oyy h GLN 232 CO 0.08 -0.01 0.00 0.39 -0.95 0.00 0.00 178.83 178.34 1oyy n GLU 233 N -5.44 0.17 0.13 1.46 1.02 -0.04 -0.06 120.64 117.89 1oyy n GLU 233 Ca 0.09 0.51 0.11 0.00 -0.02 0.00 0.00 57.16 57.85 1oyy n GLU 233 Cb 0.38 -1.91 0.51 0.00 -0.02 0.00 0.00 31.44 30.39 1oyy n GLU 233 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1oyy n GLN 234 N -2.25 0.17 -4.15 3.49 1.13 -0.34 -4.93 117.38 110.50 1oyy n GLN 234 Ca 0.01 0.48 -0.32 0.00 -1.94 0.00 0.00 57.00 55.23 1oyy n GLN 234 Cb 0.15 -1.88 -0.05 0.00 0.11 0.00 0.00 30.24 28.56 1oyy n GLN 234 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1oyy n ARG 235 N -2.21 -1.55 0.00 -1.09 1.74 0.91 -2.36 116.66 112.09 1oyy n ARG 235 Ca 0.01 0.20 0.00 0.00 -0.77 0.00 0.00 57.85 57.29 1oyy n ARG 235 Cb 0.17 -3.74 0.00 0.00 -1.02 0.00 0.00 32.46 27.86 1oyy n ARG 235 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1oyy n GLY 236 N -2.30 3.02 3.57 -0.13 0.00 -1.26 -5.06 105.19 103.02 1oyy n GLY 236 Ca -0.28 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.33 1oyy n GLY 236 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1oyy n LYS 237 N -2.00 1.06 -2.30 1.61 5.02 -1.00 -4.94 118.16 115.61 1oyy n LYS 237 Ca 0.00 0.39 -0.37 0.00 -2.02 0.00 0.00 58.31 56.31 1oyy n LYS 237 Cb 0.00 -1.94 -0.01 0.00 -0.02 0.00 0.00 35.03 33.06 1oyy n LYS 237 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1oyy s SER 238 N -0.90 6.20 0.19 4.39 1.04 -1.26 -4.88 113.70 118.49 1oyy s SER 238 Ca 0.66 2.24 -0.23 0.00 0.48 0.00 0.00 55.95 59.11 1oyy s SER 238 Cb -0.53 -2.60 0.05 0.00 0.10 0.00 0.00 66.02 63.05 1oyy s SER 238 CO 0.55 -0.89 0.67 -0.83 0.98 0.00 0.00 173.24 173.72 1oyy s GLY 239 N -1.45 -0.41 -0.05 7.32 0.00 0.23 -1.05 107.32 111.91 1oyy s GLY 239 Ca 0.64 0.22 0.06 0.00 0.00 0.00 0.00 44.72 45.64 1oyy s GLY 239 CO 0.32 0.07 -0.24 -0.42 0.00 0.00 0.00 173.10 172.84 1oyy s ILE 240 N -3.76 1.95 -0.14 0.90 1.01 -0.69 -1.49 121.20 118.97 1oyy s ILE 240 Ca 0.05 -1.02 0.01 0.00 0.00 0.00 0.00 60.65 59.70 1oyy s ILE 240 Cb -0.03 -1.64 0.02 0.00 0.01 0.00 0.00 42.46 40.82 1oyy s ILE 240 CO -0.05 0.55 -0.17 -0.63 0.00 0.00 0.00 174.94 174.63 1oyy s ILE 241 N -0.23 1.75 -0.21 2.92 1.01 -0.78 -0.29 121.20 125.37 1oyy s ILE 241 Ca -0.01 -0.77 -0.11 0.00 0.00 0.00 0.00 60.65 59.76 1oyy s ILE 241 Cb -0.12 -1.60 -0.05 0.00 0.01 0.00 0.00 42.46 40.70 1oyy s ILE 241 CO 0.02 0.49 0.19 -0.31 0.00 0.00 0.00 174.94 175.34 1oyy s TYR 242 N 1.19 3.37 0.14 3.97 2.02 -0.38 -0.51 117.35 127.15 1oyy s TYR 242 Ca -0.00 0.35 0.05 0.00 -0.37 0.00 0.00 57.07 57.10 1oyy s TYR 242 Cb -0.14 -2.27 -0.04 0.00 -0.40 0.00 0.00 41.96 39.11 1oyy s TYR 242 CO -0.07 0.15 -0.12 0.00 -1.57 0.00 0.00 175.55 173.94 1oyy n ASN 244 N 0.00 3.20 -3.86 0.00 0.23 -1.26 -4.17 115.26 109.41 1oyy n ASN 244 Ca -0.12 -1.97 -0.11 0.00 -0.53 0.00 0.00 54.58 51.85 1oyy n ASN 244 Cb 0.60 -0.34 -0.10 0.00 -2.08 0.00 0.00 39.78 37.85 1oyy n ASN 244 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 1oyy s SER 245 N -1.19 -0.02 0.35 0.53 1.04 -1.26 -5.03 113.70 108.12 1oyy s SER 245 Ca 0.40 -0.07 0.03 0.00 0.48 0.00 0.00 55.95 56.78 1oyy s SER 245 Cb 0.22 0.24 0.64 0.00 0.10 0.00 0.00 66.02 67.22 1oyy s SER 245 CO 0.29 -0.29 1.99 -0.09 0.98 0.00 0.00 173.24 176.12 1oyy h ARG 246 N 4.66 0.83 0.00 4.02 2.43 -1.98 -0.33 114.38 124.02 1oyy h ARG 246 Ca -0.29 -0.05 -0.14 0.00 -0.81 0.00 0.00 59.98 58.69 1oyy h ARG 246 Cb 1.19 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.54 1oyy h ARG 246 CO 0.40 0.55 -0.65 0.00 -1.51 0.00 0.00 179.97 178.77 1oyy h ALA 247 N 1.59 0.75 -0.29 2.80 0.00 -1.98 0.69 119.26 122.82 1oyy h ALA 247 Ca 0.26 -0.59 -0.04 0.00 0.00 0.00 0.00 54.91 54.55 1oyy h ALA 247 Cb -0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1oyy h ALA 247 CO -0.07 0.81 0.04 0.87 0.00 0.00 0.00 179.25 180.91 1oyy h LYS 248 N 0.00 0.48 0.25 0.00 1.57 -1.53 0.74 116.57 118.09 1oyy h LYS 248 Ca -0.01 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1oyy h LYS 248 Cb 1.29 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.52 1oyy h LYS 248 CO 0.08 0.59 -0.35 0.28 -0.57 0.00 0.00 179.45 179.49 1oyy h VAL 249 N 0.30 0.00 -0.02 0.50 2.07 -0.88 0.29 116.25 118.51 1oyy h VAL 249 Ca 0.09 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.64 1oyy h VAL 249 Cb 0.34 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.07 1oyy h VAL 249 CO 0.01 0.00 -0.26 -0.33 0.02 0.00 0.00 177.57 177.01 1oyy h GLU 250 N -0.62 -0.37 -0.90 1.57 5.08 -0.69 -1.11 114.58 117.54 1oyy h GLU 250 Ca -0.03 0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1oyy h GLU 250 Cb 0.56 0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.85 1oyy h GLU 250 CO -0.10 -0.25 0.59 -0.44 -1.00 0.00 0.00 179.01 177.82 1oyy h ASP 251 N -0.38 1.04 -0.16 1.42 5.19 0.59 -2.02 116.42 122.10 1oyy h ASP 251 Ca 0.07 -0.03 -0.11 0.00 -0.62 0.00 0.00 57.03 56.34 1oyy h ASP 251 Cb 0.48 -0.26 -0.01 0.00 0.18 0.00 0.00 39.33 39.72 1oyy h ASP 251 CO -0.24 0.76 -0.25 0.74 -3.12 0.00 0.00 179.24 177.13 1oyy h THR 252 N 1.22 1.27 0.07 0.35 2.02 -0.13 -1.49 112.91 116.22 1oyy h THR 252 Ca 0.33 -1.31 -0.00 0.00 0.77 0.00 0.00 66.41 66.19 1oyy h THR 252 Cb -0.13 1.30 0.00 0.00 -1.74 0.00 0.00 68.15 67.58 1oyy h THR 252 CO -0.07 0.43 -0.03 0.00 0.37 0.00 0.00 175.52 176.21 1oyy h ALA 253 N 1.20 -0.10 -0.10 6.16 0.00 -0.95 -1.55 119.26 123.93 1oyy h ALA 253 Ca 0.08 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1oyy h ALA 253 Cb 0.71 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 1oyy h ALA 253 CO 0.05 -0.55 -0.01 0.00 0.00 0.00 0.00 179.25 178.74 1oyy h ALA 254 N 0.82 0.07 -0.67 0.00 0.00 -1.09 -1.15 119.26 117.25 1oyy h ALA 254 Ca -0.01 0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.00 1oyy h ALA 254 Cb 0.08 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.87 1oyy h ALA 254 CO 0.02 -0.48 0.36 0.00 0.00 0.00 0.00 179.25 179.15 1oyy h ARG 255 N 0.02 0.64 -0.09 0.00 3.08 -1.06 -1.13 114.38 115.84 1oyy h ARG 255 Ca 0.05 -0.04 0.01 0.00 0.07 0.00 0.00 59.98 60.07 1oyy h ARG 255 Cb 0.06 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 1oyy h ARG 255 CO -0.09 0.42 0.02 -0.07 -1.07 0.00 0.00 179.97 179.18 1oyy h LEU 256 N 0.66 0.01 -0.69 3.04 3.38 -0.89 -2.67 115.31 118.16 1oyy h LEU 256 Ca 0.31 0.01 0.14 0.00 0.09 0.00 0.00 57.88 58.43 1oyy h LEU 256 Cb 0.23 0.02 -0.13 0.00 0.09 0.00 0.00 40.66 40.87 1oyy h LEU 256 CO -0.20 0.02 -0.15 1.56 0.09 0.00 0.00 178.44 179.76 1oyy h GLN 257 N 0.06 0.01 0.00 1.13 4.20 -0.75 0.28 115.11 120.04 1oyy h GLN 257 Ca 0.04 -0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.75 1oyy h GLN 257 Cb 0.03 -0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.81 1oyy h GLN 257 CO -0.05 0.01 -0.01 0.66 -0.67 0.00 0.00 178.83 178.77 1oyy h SER 258 N 0.01 0.00 -0.57 1.46 4.64 -0.94 0.11 113.55 118.27 1oyy h SER 258 Ca 0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 1oyy h SER 258 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 1oyy h SER 258 CO -0.69 0.01 0.00 0.29 -0.87 0.00 0.00 176.83 175.56 1oyy n LYS 259 N -3.38 4.30 -0.92 4.77 4.76 0.91 -4.93 118.16 123.66 1oyy n LYS 259 Ca -0.03 -3.03 0.00 0.00 -2.87 0.00 0.00 58.31 52.38 1oyy n LYS 259 Cb 0.09 -2.09 0.00 0.00 -1.84 0.00 0.00 35.03 31.19 1oyy n LYS 259 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1oyy n GLY 260 N 0.71 0.51 3.68 0.72 0.00 0.38 -5.03 105.19 106.17 1oyy n GLY 260 Ca 0.26 -0.22 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 1oyy n GLY 260 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1oyy s ILE 261 N -2.00 5.17 -0.79 -0.61 1.01 -0.86 -4.98 121.20 118.14 1oyy s ILE 261 Ca 0.00 0.81 -0.25 0.00 0.00 0.00 0.00 60.65 61.21 1oyy s ILE 261 Cb 0.00 -3.77 -0.03 0.00 0.01 0.00 0.00 42.46 38.67 1oyy s ILE 261 CO 0.00 0.24 1.88 -0.55 0.00 0.00 0.00 174.94 176.51 1oyy s SER 262 N 0.99 5.27 -0.04 3.58 0.15 -1.26 -3.62 113.70 118.77 1oyy s SER 262 Ca 0.21 -0.32 0.02 0.00 0.70 0.00 0.00 55.95 56.57 1oyy s SER 262 Cb -0.15 -2.55 0.01 0.00 -1.71 0.00 0.00 66.02 61.62 1oyy s SER 262 CO 0.09 -2.54 -0.09 0.00 1.20 0.00 0.00 173.24 171.90 1oyy s ALA 263 N 9.40 0.95 0.31 5.45 0.00 -1.26 -1.66 121.76 134.94 1oyy s ALA 263 Ca 0.67 -0.31 0.08 0.00 0.00 0.00 0.00 51.96 52.41 1oyy s ALA 263 Cb -0.09 -0.41 -0.06 0.00 0.00 0.00 0.00 23.12 22.57 1oyy s ALA 263 CO 0.07 0.11 -0.08 0.00 0.00 0.00 0.00 175.76 175.86 1oyy s ALA 264 N 0.45 2.67 0.03 0.00 0.00 0.76 -4.76 121.76 120.91 1oyy s ALA 264 Ca -0.08 -1.99 -0.16 0.00 0.00 0.00 0.00 51.96 49.73 1oyy s ALA 264 Cb -0.12 0.05 -0.06 0.00 0.00 0.00 0.00 23.12 22.99 1oyy s ALA 264 CO 0.01 0.02 0.46 0.00 0.00 0.00 0.00 175.76 176.26 1oyy s ALA 265 N -2.79 3.66 -0.02 0.00 0.00 -1.26 -0.34 121.76 121.01 1oyy s ALA 265 Ca 0.31 -0.14 0.00 0.00 0.00 0.00 0.00 51.96 52.14 1oyy s ALA 265 Cb 0.03 -2.47 0.02 0.00 0.00 0.00 0.00 23.12 20.70 1oyy s ALA 265 CO 0.14 0.46 0.00 -0.47 0.00 0.00 0.00 175.76 175.89 1oyy s TYR 266 N -1.11 0.23 0.02 0.00 6.14 0.11 -4.87 117.35 117.87 1oyy s TYR 266 Ca 0.26 0.02 -0.29 0.00 0.64 0.00 0.00 57.07 57.70 1oyy s TYR 266 Cb -0.17 -0.32 0.10 0.00 0.42 0.00 0.00 41.96 41.99 1oyy s TYR 266 CO 0.16 -0.10 1.10 -3.38 0.64 0.00 0.00 175.55 173.97 1oyy s HIS 267 N 0.82 -0.13 0.53 4.97 -3.43 -1.26 -2.51 115.29 114.29 1oyy s HIS 267 Ca -0.08 -0.04 0.36 0.00 -0.80 0.00 0.00 55.06 54.50 1oyy s HIS 267 Cb -0.11 0.57 1.52 0.00 -1.43 0.00 0.00 32.58 33.14 1oyy s HIS 267 CO -0.02 -0.49 1.79 0.00 -2.00 0.00 0.00 174.74 174.02 1oyy h ALA 268 N 2.00 3.08 -0.18 -1.38 0.00 -1.97 -1.95 119.26 118.87 1oyy h ALA 268 Ca -0.24 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1oyy h ALA 268 Cb 1.21 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1oyy h ALA 268 CO 0.27 -1.43 0.00 0.41 0.00 0.00 0.00 179.25 178.50 1oyy n GLY 269 N -1.75 0.51 3.91 0.00 0.00 -1.26 -4.80 105.19 101.80 1oyy n GLY 269 Ca 0.26 -0.21 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 1oyy n GLY 269 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1oyy s LEU 270 N -0.91 4.19 0.43 0.99 1.43 -0.73 -5.10 118.68 118.97 1oyy s LEU 270 Ca 0.13 0.56 -0.21 0.00 -1.03 0.00 0.00 54.13 53.57 1oyy s LEU 270 Cb 0.08 -3.33 -0.10 0.00 0.03 0.00 0.00 46.19 42.87 1oyy s LEU 270 CO 0.07 -0.07 0.97 -1.83 0.23 0.00 0.00 176.35 175.72 1oyy s GLU 271 N -3.21 4.19 0.24 1.70 -1.05 -1.26 -4.81 118.70 114.51 1oyy s GLU 271 Ca 0.41 1.19 -0.04 0.00 -0.15 0.00 0.00 54.97 56.38 1oyy s GLU 271 Cb -0.11 -2.24 0.45 0.00 -0.44 0.00 0.00 34.13 31.79 1oyy s GLU 271 CO 0.28 -0.07 1.73 -0.91 0.95 0.00 0.00 175.26 177.24 1oyy h ASN 272 N 2.00 0.28 0.63 0.83 2.35 -1.99 1.06 115.58 120.75 1oyy h ASN 272 Ca -0.49 0.11 0.00 0.00 -0.55 0.00 0.00 56.30 55.37 1oyy h ASN 272 Cb 1.19 0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.64 1oyy h ASN 272 CO 0.61 0.11 0.00 -0.55 -1.65 0.00 0.00 177.43 175.95 1oyy h ASN 273 N 0.45 0.00 0.18 5.81 7.08 -2.00 -2.99 115.58 124.12 1oyy h ASN 273 Ca 0.41 0.00 -0.30 0.00 -3.08 0.00 0.00 56.30 53.33 1oyy h ASN 273 Cb 0.61 0.00 0.02 0.00 -2.08 0.00 0.00 38.32 36.87 1oyy h ASN 273 CO -0.40 0.00 -1.45 0.58 -2.08 0.00 0.00 177.43 174.08 1oyy h VAL 274 N 0.00 1.15 -0.08 6.14 2.07 0.78 -2.89 116.25 123.41 1oyy h VAL 274 Ca 0.00 -2.54 0.03 0.00 0.82 0.00 0.00 66.70 65.01 1oyy h VAL 274 Cb 0.32 2.91 -0.03 0.00 -1.52 0.00 0.00 31.29 32.96 1oyy h VAL 274 CO 0.00 0.79 -0.11 0.03 0.02 0.00 0.00 177.57 178.30 1oyy h ARG 275 N -0.05 -0.14 0.00 1.57 3.08 -1.23 -1.63 114.38 115.98 1oyy h ARG 275 Ca -0.28 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 59.77 1oyy h ARG 275 Cb 1.97 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 32.05 1oyy h ARG 275 CO 0.18 -0.09 -0.05 0.00 -1.07 0.00 0.00 179.97 178.94 1oyy h ALA 276 N 0.91 1.78 -0.16 0.04 0.00 -1.65 0.36 119.26 120.53 1oyy h ALA 276 Ca 0.07 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 1oyy h ALA 276 Cb 0.24 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1oyy h ALA 276 CO -0.17 0.06 -0.28 0.22 0.00 0.00 0.00 179.25 179.08 1oyy h ASP 277 N 0.00 0.53 -0.13 0.00 3.58 -1.21 -0.54 116.42 118.64 1oyy h ASP 277 Ca -0.00 -0.54 0.04 0.00 0.42 0.00 0.00 57.03 56.95 1oyy h ASP 277 Cb 0.09 -0.15 -0.04 0.00 1.72 0.00 0.00 39.33 40.95 1oyy h ASP 277 CO 0.01 0.97 -0.10 0.58 -2.88 0.00 0.00 179.24 177.81 1oyy h VAL 278 N 0.11 0.71 -0.64 2.25 2.07 -0.22 0.47 116.25 121.00 1oyy h VAL 278 Ca 0.01 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.51 1oyy h VAL 278 Cb 0.87 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 1oyy h VAL 278 CO 0.06 0.00 0.31 -0.61 0.02 0.00 0.00 177.57 177.35 1oyy h GLN 279 N -0.11 0.92 -0.27 1.57 4.15 -0.23 -0.55 115.11 120.60 1oyy h GLN 279 Ca 0.09 -0.13 -0.17 0.00 0.77 0.00 0.00 58.65 59.20 1oyy h GLN 279 Cb 0.23 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 27.76 1oyy h GLN 279 CO -0.20 0.73 -0.50 1.49 -1.93 0.00 0.00 178.83 178.43 1oyy h GLU 280 N 0.88 0.81 0.00 1.69 4.81 -0.53 0.55 114.58 122.79 1oyy h GLU 280 Ca 0.22 -0.51 -0.04 0.00 -0.13 0.00 0.00 59.36 58.89 1oyy h GLU 280 Cb 0.12 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 1oyy h GLU 280 CO -0.03 1.14 -0.21 0.87 -0.73 0.00 0.00 179.01 180.06 1oyy h LYS 281 N 0.56 0.00 0.10 1.92 1.79 0.42 -0.98 116.57 120.39 1oyy h LYS 281 Ca 0.01 0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 58.30 1oyy h LYS 281 Cb 1.10 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 31.77 1oyy h LYS 281 CO 0.11 0.21 -0.78 0.35 -1.08 0.00 0.00 179.45 178.26 1oyy h PHE 282 N 0.00 0.60 -0.76 -1.35 3.57 -0.88 0.15 116.94 118.28 1oyy h PHE 282 Ca -0.00 -0.40 0.12 0.00 3.53 0.00 0.00 57.97 61.22 1oyy h PHE 282 Cb 0.39 -0.04 -0.08 0.00 2.79 0.00 0.00 35.95 39.00 1oyy h PHE 282 CO 0.00 1.27 0.36 0.37 -2.23 0.00 0.00 178.31 178.08 1oyy h GLN 283 N -0.24 0.55 -0.08 1.11 5.75 0.13 -1.37 115.11 120.96 1oyy h GLN 283 Ca -0.13 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.34 1oyy h GLN 283 Cb 1.56 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 29.99 1oyy h GLN 283 CO 0.15 0.36 0.00 0.54 -2.65 0.00 0.00 178.83 177.23 1oyy n ARG 284 N -4.90 1.49 -3.20 1.69 1.74 -0.52 -4.94 116.66 108.01 1oyy n ARG 284 Ca 0.13 -0.73 -0.18 0.00 -0.77 0.00 0.00 57.85 56.30 1oyy n ARG 284 Cb 0.35 -1.41 0.05 0.00 -1.02 0.00 0.00 32.46 30.44 1oyy n ARG 284 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1oyy n ASP 285 N -0.08 -5.29 0.06 0.55 8.00 -0.52 -4.88 116.55 114.39 1oyy n ASP 285 Ca 0.17 -0.36 -0.12 0.00 0.71 0.00 0.00 54.79 55.20 1oyy n ASP 285 Cb 0.26 -3.96 -0.13 0.00 -0.02 0.00 0.00 41.12 37.27 1oyy n ASP 285 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1oyy h ASP 286 N -1.81 0.19 -3.43 -2.24 3.32 -0.96 -3.44 116.42 108.07 1oyy h ASP 286 Ca -0.43 -0.24 -0.68 0.00 0.02 0.00 0.00 57.03 55.71 1oyy h ASP 286 Cb 1.28 -0.06 -0.16 0.00 0.22 0.00 0.00 39.33 40.61 1oyy h ASP 286 CO 0.43 1.19 -0.65 -0.76 -1.72 0.00 0.00 179.24 177.74 1oyy s LEU 287 N -6.79 3.45 -0.09 1.55 1.43 -0.99 -4.99 118.68 112.26 1oyy s LEU 287 Ca -0.03 0.06 -0.23 0.00 -1.03 0.00 0.00 54.13 52.90 1oyy s LEU 287 Cb 0.08 -1.82 -0.19 0.00 0.03 0.00 0.00 46.19 44.28 1oyy s LEU 287 CO 0.84 0.35 0.79 -0.61 0.23 0.00 0.00 176.35 177.95 1oyy h GLN 288 N 5.00 -0.05 -4.98 1.70 4.15 -1.69 -3.43 115.11 115.81 1oyy h GLN 288 Ca -0.50 0.00 -0.53 0.00 0.77 0.00 0.00 58.65 58.39 1oyy h GLN 288 Cb 1.18 0.01 -0.32 0.00 0.21 0.00 0.00 27.48 28.57 1oyy h GLN 288 CO 0.54 0.60 -0.82 0.42 -1.93 0.00 0.00 178.83 177.64 1oyy s ILE 289 N -2.78 1.26 -0.25 2.39 1.01 -0.66 -0.61 121.20 121.56 1oyy s ILE 289 Ca -0.15 -0.60 -0.07 0.00 0.00 0.00 0.00 60.65 59.84 1oyy s ILE 289 Cb -0.01 -1.11 -0.02 0.00 0.01 0.00 0.00 42.46 41.34 1oyy s ILE 289 CO 0.55 0.37 0.05 -0.69 0.00 0.00 0.00 174.94 175.23 1oyy s VAL 290 N 0.24 4.04 -0.23 2.92 1.01 -0.56 -0.17 120.40 127.65 1oyy s VAL 290 Ca -0.07 -0.37 -0.12 0.00 0.00 0.00 0.00 61.98 61.43 1oyy s VAL 290 Cb -0.12 -2.93 -0.05 0.00 0.00 0.00 0.00 36.38 33.28 1oyy s VAL 290 CO 0.03 0.29 0.21 -0.69 0.00 0.00 0.00 175.10 174.94 1oyy s VAL 291 N 1.56 5.33 0.15 2.92 1.01 0.54 -1.86 120.40 130.05 1oyy s VAL 291 Ca 0.05 0.30 -0.11 0.00 0.00 0.00 0.00 61.98 62.22 1oyy s VAL 291 Cb -0.15 -3.55 0.00 0.00 0.00 0.00 0.00 36.38 32.68 1oyy s VAL 291 CO 0.02 0.33 0.32 0.00 0.00 0.00 0.00 175.10 175.77 1oyy s ALA 292 N 1.07 -0.31 0.65 5.51 0.00 0.33 0.10 121.76 129.11 1oyy s ALA 292 Ca 0.10 -0.63 -0.02 0.00 0.00 0.00 0.00 51.96 51.42 1oyy s ALA 292 Cb -0.14 0.77 0.07 0.00 0.00 0.00 0.00 23.12 23.83 1oyy s ALA 292 CO 0.05 -0.65 0.48 0.25 0.00 0.00 0.00 175.76 175.89 1oyy n THR 293 N -0.21 0.00 0.00 0.00 -2.24 -1.04 -0.26 114.28 110.53 1oyy n THR 293 Ca -0.10 -0.64 0.00 0.00 -2.27 0.00 0.00 64.05 61.04 1oyy n THR 293 Cb 0.63 -1.31 0.00 0.00 -2.10 0.00 0.00 70.33 67.55 1oyy n THR 293 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1oyy n VAL 294 N -2.22 0.91 -2.70 2.28 0.24 -1.26 -4.88 118.33 110.69 1oyy n VAL 294 Ca 0.07 0.24 -0.33 0.00 -2.04 0.00 0.00 64.34 62.28 1oyy n VAL 294 Cb 0.26 -1.24 -0.06 0.00 -1.47 0.00 0.00 33.84 31.33 1oyy n VAL 294 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1oyy s ALA 295 N -2.43 3.00 0.00 2.33 0.00 -1.26 -5.13 121.76 118.27 1oyy s ALA 295 Ca 0.00 0.42 0.00 0.00 0.00 0.00 0.00 51.96 52.38 1oyy s ALA 295 Cb 0.00 -3.17 0.00 0.00 0.00 0.00 0.00 23.12 19.95 1oyy s ALA 295 CO 0.00 -0.02 0.24 0.44 0.00 0.00 0.00 175.76 176.42 1oyy n ILE 300 N -0.83 0.00 -3.54 0.00 -5.35 -1.26 -4.89 119.36 103.49 1oyy n ILE 300 Ca 0.07 0.00 -0.22 0.00 -0.27 0.00 0.00 62.75 62.34 1oyy n ILE 300 Cb 0.54 0.51 0.05 0.00 -1.74 0.00 0.00 39.64 39.00 1oyy n ILE 300 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1oyy n ASN 301 N 0.00 -3.86 -4.74 7.28 4.13 -1.26 -4.98 115.26 111.83 1oyy n ASN 301 Ca 0.00 -0.82 -0.37 0.00 1.68 0.00 0.00 54.58 55.08 1oyy n ASN 301 Cb 0.49 -4.34 -0.07 0.00 -1.54 0.00 0.00 39.78 34.33 1oyy n ASN 301 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1oyy s LYS 302 N -5.46 4.23 0.42 3.52 2.20 -1.26 -5.00 119.74 118.40 1oyy s LYS 302 Ca 0.25 0.20 0.21 0.00 -0.36 0.00 0.00 55.97 56.28 1oyy s LYS 302 Cb -0.06 -3.41 0.92 0.00 -1.51 0.00 0.00 37.83 33.77 1oyy s LYS 302 CO 0.79 0.26 1.84 -1.35 -0.36 0.00 0.00 175.35 176.54 1oyy h PRO 303 N 6.50 0.00 -2.31 4.03 0.11 -1.92 -3.36 132.00 135.05 1oyy h PRO 303 Ca -0.42 0.00 -0.65 0.00 0.11 0.00 0.00 66.00 65.04 1oyy h PRO 303 Cb 1.17 0.00 -0.38 0.00 0.11 0.00 0.00 31.00 31.90 1oyy h PRO 303 CO 0.74 0.28 -0.22 0.27 -0.21 0.00 0.00 178.00 178.86 1oyy n ASN 304 N -3.58 4.98 -4.66 -2.05 6.94 -1.26 0.88 115.26 116.51 1oyy n ASN 304 Ca -0.01 -3.61 -0.38 0.00 -0.02 0.00 0.00 54.58 50.56 1oyy n ASN 304 Cb 0.42 -0.75 -0.08 0.00 -2.36 0.00 0.00 39.78 37.01 1oyy n ASN 304 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1oyy s VAL 305 N -3.86 5.19 -0.04 3.53 1.01 -1.26 -4.83 120.40 120.13 1oyy s VAL 305 Ca 0.44 0.69 0.11 0.00 0.00 0.00 0.00 61.98 63.22 1oyy s VAL 305 Cb 0.22 -3.73 -0.23 0.00 0.00 0.00 0.00 36.38 32.64 1oyy s VAL 305 CO -0.09 0.23 0.66 0.03 0.00 0.00 0.00 175.10 175.94 1oyy h ARG 306 N 7.49 0.02 -3.58 2.72 2.47 -1.44 0.13 114.38 122.20 1oyy h ARG 306 Ca -0.35 -0.04 -0.17 0.00 -1.26 0.00 0.00 59.98 58.17 1oyy h ARG 306 Cb 1.16 0.01 -0.23 0.00 -1.65 0.00 0.00 29.97 29.27 1oyy h ARG 306 CO 0.71 0.56 -0.56 -0.59 0.56 0.00 0.00 179.97 180.65 1oyy s PHE 307 N -2.60 0.03 -0.11 3.04 -0.71 -0.60 -1.48 117.98 115.55 1oyy s PHE 307 Ca -0.06 -0.07 0.02 0.00 -1.04 0.00 0.00 56.93 55.78 1oyy s PHE 307 Cb 0.08 -0.05 0.01 0.00 -1.21 0.00 0.00 43.02 41.86 1oyy s PHE 307 CO 0.82 -0.20 -0.17 0.08 -1.34 0.00 0.00 175.22 174.41 1oyy s VAL 308 N -0.95 1.60 -0.11 -2.49 1.01 -0.01 -1.70 120.40 117.75 1oyy s VAL 308 Ca -0.10 -0.71 -0.00 0.00 0.00 0.00 0.00 61.98 61.16 1oyy s VAL 308 Cb -0.06 -1.45 -0.02 0.00 0.00 0.00 0.00 36.38 34.85 1oyy s VAL 308 CO 0.01 0.46 -0.09 -0.69 0.00 0.00 0.00 175.10 174.79 1oyy s VAL 309 N 0.91 3.44 -0.31 2.92 1.01 0.60 -1.33 120.40 127.65 1oyy s VAL 309 Ca -0.08 -0.55 -0.10 0.00 0.00 0.00 0.00 61.98 61.26 1oyy s VAL 309 Cb -0.15 -2.44 -0.01 0.00 0.00 0.00 0.00 36.38 33.78 1oyy s VAL 309 CO -0.01 0.55 0.15 -1.00 0.00 0.00 0.00 175.10 174.79 1oyy s HIS 310 N -0.15 3.18 -0.03 5.22 3.76 -0.46 -1.25 115.29 125.55 1oyy s HIS 310 Ca 0.01 -0.51 0.11 0.00 -0.15 0.00 0.00 55.06 54.52 1oyy s HIS 310 Cb -0.13 -2.35 -0.07 0.00 1.11 0.00 0.00 32.58 31.13 1oyy s HIS 310 CO 0.03 -0.43 1.34 0.35 -0.85 0.00 0.00 174.74 175.18 1oyy h PHE 311 N 8.35 0.00 -4.01 1.40 3.57 -1.37 -1.19 116.94 123.68 1oyy h PHE 311 Ca -0.33 0.00 -0.61 0.00 3.53 0.00 0.00 57.97 60.57 1oyy h PHE 311 Cb 1.15 0.00 -0.23 0.00 2.79 0.00 0.00 35.95 39.66 1oyy h PHE 311 CO 0.65 0.74 -0.85 -0.51 -2.23 0.00 0.00 178.31 176.11 1oyy s ASP 312 N -6.55 2.78 0.11 0.41 1.11 -1.26 -4.55 116.67 108.73 1oyy s ASP 312 Ca 0.02 -0.66 -0.29 0.00 0.18 0.00 0.00 52.55 51.81 1oyy s ASP 312 Cb 0.09 -0.19 -0.06 0.00 1.07 0.00 0.00 42.92 43.83 1oyy s ASP 312 CO 0.78 0.13 0.92 -0.51 1.18 0.00 0.00 175.17 177.67 1oyy s ILE 313 N -1.02 4.49 1.09 0.77 2.07 -1.26 -4.92 121.20 122.41 1oyy s ILE 313 Ca 0.09 1.98 -0.12 0.00 -1.41 0.00 0.00 60.65 61.19 1oyy s ILE 313 Cb -0.10 -4.28 0.24 0.00 0.13 0.00 0.00 42.46 38.45 1oyy s ILE 313 CO 0.04 0.35 1.06 -2.84 -1.91 0.00 0.00 174.94 171.64 1oyy s PRO 314 N -0.18 -0.30 0.01 3.50 0.02 -1.26 -4.93 135.00 131.86 1oyy s PRO 314 Ca 0.44 0.84 0.25 0.00 0.02 0.00 0.00 61.00 62.55 1oyy s PRO 314 Cb -0.23 -1.63 0.49 0.00 0.02 0.00 0.00 34.50 33.15 1oyy s PRO 314 CO 0.29 -3.31 1.41 0.54 -0.33 0.00 0.00 177.00 175.60 1oyy n ARG 315 N -4.62 0.03 -3.64 5.54 1.74 -1.26 -4.90 116.66 109.54 1oyy n ARG 315 Ca 0.05 0.01 -0.11 0.00 -0.77 0.00 0.00 57.85 57.02 1oyy n ARG 315 Cb 0.55 -1.52 -0.05 0.00 -1.02 0.00 0.00 32.46 30.42 1oyy n ARG 315 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1oyy s ASN 316 N -3.13 -0.23 0.18 0.55 2.20 -1.26 -3.41 114.94 109.85 1oyy s ASN 316 Ca 0.10 -0.27 -0.13 0.00 -0.94 0.00 0.00 52.86 51.63 1oyy s ASN 316 Cb 0.17 0.46 0.09 0.00 -2.00 0.00 0.00 41.25 39.97 1oyy s ASN 316 CO 0.70 -0.81 1.84 0.40 -2.94 0.00 0.00 177.10 176.29 1oyy h ILE 317 N 2.49 1.16 -0.60 0.54 2.04 -1.91 -1.19 117.51 120.04 1oyy h ILE 317 Ca -0.33 -0.32 0.12 0.00 1.00 0.00 0.00 64.86 65.33 1oyy h ILE 317 Cb 1.25 0.31 -0.12 0.00 -0.74 0.00 0.00 36.82 37.52 1oyy h ILE 317 CO 0.47 0.16 -0.19 -0.33 0.00 0.00 0.00 178.15 178.26 1oyy h GLU 318 N 0.80 -0.04 -0.49 2.37 3.07 -1.98 0.46 114.58 118.77 1oyy h GLU 318 Ca 0.22 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 59.03 1oyy h GLU 318 Cb -0.07 0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 27.83 1oyy h GLU 318 CO -0.04 -0.03 0.12 0.77 -1.40 0.00 0.00 179.01 178.43 1oyy h SER 319 N -0.04 0.75 -0.75 1.42 0.02 -1.92 -1.00 113.55 112.02 1oyy h SER 319 Ca 0.28 -0.23 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 1oyy h SER 319 Cb 0.48 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 62.78 1oyy h SER 319 CO -0.64 0.78 0.38 0.22 -1.14 0.00 0.00 176.83 176.44 1oyy h TYR 320 N 0.68 1.08 -0.36 3.45 3.20 0.24 -1.74 116.97 123.51 1oyy h TYR 320 Ca 0.16 -0.04 -0.08 0.00 3.14 0.00 0.00 58.73 61.91 1oyy h TYR 320 Cb 0.32 -0.34 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 1oyy h TYR 320 CO 0.02 0.77 -0.09 -0.92 -1.64 0.00 0.00 178.16 176.30 1oyy h TYR 321 N 1.08 0.79 -0.31 -3.82 3.20 0.04 -1.72 116.97 116.23 1oyy h TYR 321 Ca 0.27 -0.17 -0.10 0.00 3.14 0.00 0.00 58.73 61.87 1oyy h TYR 321 Cb 0.08 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.15 1oyy h TYR 321 CO 0.01 0.85 -0.19 -0.56 -1.64 0.00 0.00 178.16 176.63 1oyy h GLN 322 N 0.49 0.67 -0.05 1.82 3.07 -1.07 0.45 115.11 120.50 1oyy h GLN 322 Ca 0.09 -0.31 -0.00 0.00 0.09 0.00 0.00 58.65 58.51 1oyy h GLN 322 Cb 0.60 -0.01 -0.00 0.00 0.08 0.00 0.00 27.48 28.15 1oyy h GLN 322 CO 0.04 0.91 0.02 0.93 0.09 0.00 0.00 178.83 180.82 1oyy h GLU 323 N 0.43 0.08 0.00 0.06 5.08 -1.31 -2.73 114.58 116.19 1oyy h GLU 323 Ca 0.06 -0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.33 1oyy h GLU 323 Cb 0.73 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 1oyy h GLU 323 CO 0.05 0.22 -0.38 1.79 -1.00 0.00 0.00 179.01 179.70 1oyy h THR 324 N -0.09 1.02 0.00 1.13 1.35 -1.39 -2.63 112.91 112.30 1oyy h THR 324 Ca 0.02 -1.41 0.00 0.00 -0.55 0.00 0.00 66.41 64.46 1oyy h THR 324 Cb 0.18 1.82 0.00 0.00 -1.73 0.00 0.00 68.15 68.42 1oyy h THR 324 CO -0.00 0.37 0.00 0.61 -0.25 0.00 0.00 175.52 176.25 1oyy n GLY 325 N -0.07 -0.80 0.21 5.82 0.00 0.15 -0.83 105.19 109.67 1oyy n GLY 325 Ca -0.01 0.12 0.15 0.00 0.00 0.00 0.00 46.02 46.28 1oyy n GLY 325 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1oyy h ARG 326 N 0.00 0.00 -6.56 1.61 3.08 -1.44 -3.45 114.38 107.62 1oyy h ARG 326 Ca 0.00 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.53 1oyy h ARG 326 Cb 0.04 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 1oyy h ARG 326 CO 0.00 0.00 -0.04 0.00 -1.07 0.00 0.00 179.97 178.86 1oyy s ALA 327 N -3.58 3.48 -1.12 0.04 0.00 -0.01 -4.54 121.76 116.02 1oyy s ALA 327 Ca 0.01 -0.20 -0.04 0.00 0.00 0.00 0.00 51.96 51.73 1oyy s ALA 327 Cb 0.09 -2.54 0.00 0.00 0.00 0.00 0.00 23.12 20.67 1oyy s ALA 327 CO 0.39 0.39 0.51 0.41 0.00 0.00 0.00 175.76 177.46 1oyy n GLY 328 N -0.37 -0.19 0.22 0.00 0.00 0.45 -4.90 105.19 100.40 1oyy n GLY 328 Ca 0.01 -0.10 0.15 0.00 0.00 0.00 0.00 46.02 46.09 1oyy n GLY 328 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1oyy h ARG 329 N -1.16 0.00 0.00 1.61 2.47 -1.67 0.81 114.38 116.45 1oyy h ARG 329 Ca -0.39 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.33 1oyy h ARG 329 Cb 1.27 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.59 1oyy h ARG 329 CO 0.42 0.00 0.00 -0.40 0.56 0.00 0.00 179.97 180.55 1oyy n ASP 330 N -2.69 0.00 0.00 7.04 5.68 0.26 -4.94 116.55 121.89 1oyy n ASP 330 Ca 0.01 -0.03 0.00 0.00 -0.50 0.00 0.00 54.79 54.27 1oyy n ASP 330 Cb 0.23 -0.31 0.00 0.00 -1.14 0.00 0.00 41.12 39.90 1oyy n ASP 330 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1oyy n GLY 331 N 0.94 1.89 3.88 6.12 0.00 0.28 -5.01 105.19 113.29 1oyy n GLY 331 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 1oyy n GLY 331 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1oyy s LEU 332 N 0.00 3.00 0.13 0.99 1.43 -1.26 -4.74 118.68 118.23 1oyy s LEU 332 Ca 0.00 1.21 -0.31 0.00 -1.03 0.00 0.00 54.13 54.00 1oyy s LEU 332 Cb 0.00 -4.08 -0.11 0.00 0.03 0.00 0.00 46.19 42.03 1oyy s LEU 332 CO 0.00 -1.20 1.82 -2.65 0.23 0.00 0.00 176.35 174.56 1oyy n PRO 333 N -2.93 2.76 -4.40 1.29 -0.02 -1.26 -4.75 135.00 125.69 1oyy n PRO 333 Ca 0.07 1.00 -0.23 0.00 -2.02 0.00 0.00 63.50 62.32 1oyy n PRO 333 Cb 0.56 -2.89 -0.08 0.00 -0.02 0.00 0.00 33.50 31.07 1oyy n PRO 333 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1oyy s ALA 334 N 2.56 2.45 -0.05 3.55 0.00 0.16 -4.95 121.76 125.49 1oyy s ALA 334 Ca 0.81 -1.62 -0.12 0.00 0.00 0.00 0.00 51.96 51.04 1oyy s ALA 334 Cb -0.49 1.14 0.02 0.00 0.00 0.00 0.00 23.12 23.79 1oyy s ALA 334 CO 0.37 -0.51 0.27 -2.00 0.00 0.00 0.00 175.76 173.89 1oyy s GLU 335 N -3.52 0.50 -0.11 0.00 2.12 -0.55 -0.98 118.70 116.16 1oyy s GLU 335 Ca 0.32 0.01 0.03 0.00 0.36 0.00 0.00 54.97 55.69 1oyy s GLU 335 Cb 0.02 0.23 -0.00 0.00 0.26 0.00 0.00 34.13 34.63 1oyy s GLU 335 CO 0.22 -0.11 -0.22 0.00 -0.54 0.00 0.00 175.26 174.61 1oyy s ALA 336 N -0.74 2.25 -0.14 6.30 0.00 -0.71 -0.83 121.76 127.89 1oyy s ALA 336 Ca -0.08 -0.98 0.02 0.00 0.00 0.00 0.00 51.96 50.91 1oyy s ALA 336 Cb -0.04 -0.90 0.01 0.00 0.00 0.00 0.00 23.12 22.19 1oyy s ALA 336 CO 0.02 0.23 -0.19 1.41 0.00 0.00 0.00 175.76 177.23 1oyy s MET 337 N 0.43 2.70 -0.21 0.00 0.00 -0.44 -1.04 119.30 120.75 1oyy s MET 337 Ca -0.16 -0.73 -0.07 0.00 0.00 0.00 0.00 55.69 54.73 1oyy s MET 337 Cb -0.17 -2.25 -0.04 0.00 0.00 0.00 0.00 34.83 32.37 1oyy s MET 337 CO 0.07 -0.07 0.06 -1.17 0.00 0.00 0.00 175.02 173.90 1oyy s LEU 338 N 0.99 3.64 -0.26 4.11 2.96 0.73 -1.36 118.68 129.49 1oyy s LEU 338 Ca -0.04 -0.04 -0.18 0.00 -0.22 0.00 0.00 54.13 53.65 1oyy s LEU 338 Cb -0.15 -1.94 -0.03 0.00 0.50 0.00 0.00 46.19 44.58 1oyy s LEU 338 CO -0.04 0.10 0.50 -0.36 -1.32 0.00 0.00 176.35 175.23 1oyy s PHE 339 N 0.83 3.27 0.07 5.38 0.40 -0.45 -0.87 117.98 126.62 1oyy s PHE 339 Ca 0.03 0.62 0.04 0.00 -0.60 0.00 0.00 56.93 57.03 1oyy s PHE 339 Cb -0.14 -2.70 -0.03 0.00 0.51 0.00 0.00 43.02 40.67 1oyy s PHE 339 CO 0.02 -0.26 -0.12 -0.47 0.70 0.00 0.00 175.22 175.09 1oyy s TYR 340 N 2.22 1.06 -0.07 0.36 5.04 -0.66 -4.43 117.35 120.88 1oyy s TYR 340 Ca 0.21 -0.51 -0.03 0.00 -2.44 0.00 0.00 57.07 54.29 1oyy s TYR 340 Cb -0.16 -0.60 0.04 0.00 0.35 0.00 0.00 41.96 41.60 1oyy s TYR 340 CO 0.09 0.02 0.16 0.34 -1.34 0.00 0.00 175.55 174.82 1oyy s ASP 341 N -1.87 -0.01 0.50 4.32 -1.08 -1.26 -0.35 116.67 116.92 1oyy s ASP 341 Ca -0.02 0.33 0.28 0.00 -0.52 0.00 0.00 52.55 52.61 1oyy s ASP 341 Cb -0.08 0.22 1.37 0.00 -1.46 0.00 0.00 42.92 42.97 1oyy s ASP 341 CO 0.01 -0.16 1.86 1.55 0.52 0.00 0.00 175.17 178.95 1oyy h PRO 342 N 7.40 0.12 -0.46 4.34 0.13 -2.00 0.73 132.00 142.26 1oyy h PRO 342 Ca -0.39 -0.01 0.02 0.00 -0.87 0.00 0.00 66.00 64.75 1oyy h PRO 342 Cb 1.14 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 32.22 1oyy h PRO 342 CO 0.38 0.08 0.31 0.00 -0.23 0.00 0.00 178.00 178.54 1oyy h ALA 343 N 1.56 1.74 -0.86 -0.56 0.00 -1.99 -1.18 119.26 117.96 1oyy h ALA 343 Ca 0.46 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.32 1oyy h ALA 343 Cb 1.62 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 19.21 1oyy h ALA 343 CO -0.07 0.22 0.44 -0.44 0.00 0.00 0.00 179.25 179.40 1oyy h ASP 344 N 0.56 1.10 0.94 0.00 3.32 0.06 -1.56 116.42 120.84 1oyy h ASP 344 Ca 0.18 -0.12 -0.10 0.00 0.02 0.00 0.00 57.03 57.02 1oyy h ASP 344 Cb 0.03 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.28 1oyy h ASP 344 CO -0.04 0.91 -0.46 0.24 -1.72 0.00 0.00 179.24 178.16 1oyy h MET 345 N 1.22 0.00 0.00 3.56 2.86 -1.20 -2.89 114.93 118.47 1oyy h MET 345 Ca 0.30 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.86 1oyy h MET 345 Cb 0.07 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.72 1oyy h MET 345 CO -0.04 0.46 -0.37 0.00 1.06 0.00 0.00 176.91 178.02 1oyy h ALA 346 N 1.54 1.23 0.33 6.32 0.00 -0.56 -2.22 119.26 125.90 1oyy h ALA 346 Ca -0.00 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 1oyy h ALA 346 Cb 1.05 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1oyy h ALA 346 CO 0.06 0.46 -0.16 2.35 0.00 0.00 0.00 179.25 181.96 1oyy h TRP 347 N 0.00 -0.41 -0.89 0.00 -0.00 -1.21 -1.65 115.95 111.79 1oyy h TRP 347 Ca -0.00 -0.01 0.24 0.00 -0.00 0.00 0.00 58.89 59.12 1oyy h TRP 347 Cb 0.72 0.14 -0.14 0.00 -0.00 0.00 0.00 29.16 29.88 1oyy h TRP 347 CO 0.00 -0.25 0.31 -0.07 -0.00 0.00 0.00 178.44 178.43 1oyy h LEU 348 N -0.51 0.14 -0.57 0.65 3.38 -1.53 0.66 115.31 117.53 1oyy h LEU 348 Ca -0.05 0.18 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 1oyy h LEU 348 Cb 0.34 0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 1oyy h LEU 348 CO 0.07 -0.11 0.26 0.03 0.09 0.00 0.00 178.44 178.78 1oyy h ARG 349 N 0.27 0.83 0.62 1.13 3.08 -1.17 -0.43 114.38 118.70 1oyy h ARG 349 Ca 0.57 -0.13 -0.03 0.00 0.07 0.00 0.00 59.98 60.47 1oyy h ARG 349 Cb 1.15 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 31.06 1oyy h ARG 349 CO -0.61 0.68 -0.34 -0.09 -1.07 0.00 0.00 179.97 178.54 1oyy h ARG 350 N 0.77 -0.86 -0.39 0.04 2.43 0.11 -0.04 114.38 116.45 1oyy h ARG 350 Ca 0.19 0.06 0.06 0.00 -0.81 0.00 0.00 59.98 59.48 1oyy h ARG 350 Cb 0.14 0.20 -0.09 0.00 -0.42 0.00 0.00 29.97 29.80 1oyy h ARG 350 CO -0.02 -0.57 -0.47 0.00 -1.51 0.00 0.00 179.97 177.39 1oyy h LEU 352 N -0.36 0.75 0.00 0.00 5.85 -0.94 -2.98 115.31 117.62 1oyy h LEU 352 Ca 0.11 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.73 1oyy h LEU 352 Cb 0.60 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.43 1oyy h LEU 352 CO -0.57 0.69 0.00 -0.62 -0.34 0.00 0.00 178.44 177.60 1oyy n GLU 353 N -4.31 0.80 -0.44 1.25 -0.58 -0.04 -2.25 120.64 115.08 1oyy n GLU 353 Ca 0.04 0.00 0.07 0.00 -0.42 0.00 0.00 57.16 56.86 1oyy n GLU 353 Cb 0.18 -1.48 0.18 0.00 -0.57 0.00 0.00 31.44 29.75 1oyy n GLU 353 CO 0.00 0.00 0.00 -0.85 -0.48 0.00 0.00 177.13 175.80 1oyy n GLU 354 N -0.98 1.45 -3.31 3.49 0.28 -1.12 -4.92 120.64 115.53 1oyy n GLU 354 Ca 0.19 -3.03 -0.24 0.00 -0.16 0.00 0.00 57.16 53.91 1oyy n GLU 354 Cb 0.09 -1.55 -0.01 0.00 1.43 0.00 0.00 31.44 31.39 1oyy n GLU 354 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 1oyy s LYS 355 N -3.05 3.50 -0.28 3.44 1.02 -0.95 -5.00 119.74 118.41 1oyy s LYS 355 Ca 0.36 -0.26 -0.39 0.00 0.02 0.00 0.00 55.97 55.70 1oyy s LYS 355 Cb 0.34 -2.64 -0.14 0.00 -0.52 0.00 0.00 37.83 34.87 1oyy s LYS 355 CO -0.04 0.12 1.87 -0.35 -0.92 0.00 0.00 175.35 176.04 1oyy n PRO 356 N -1.77 1.23 -0.81 -1.68 -0.04 -1.26 -4.93 135.00 125.73 1oyy n PRO 356 Ca -0.04 0.43 -0.33 0.00 -0.04 0.00 0.00 63.50 63.52 1oyy n PRO 356 Cb 0.56 -2.22 0.11 0.00 -0.04 0.00 0.00 33.50 31.91 1oyy n PRO 356 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1oyy n GLN 357 N 6.23 -0.27 0.00 0.54 1.13 -1.26 -4.47 117.38 119.28 1oyy n GLN 357 Ca 0.30 -0.04 0.00 0.00 -1.94 0.00 0.00 57.00 55.32 1oyy n GLN 357 Cb 0.16 -1.78 0.00 0.00 0.11 0.00 0.00 30.24 28.73 1oyy n GLN 357 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1oyy n GLY 358 N 1.67 0.73 0.29 1.08 0.00 -1.26 -4.86 105.19 102.84 1oyy n GLY 358 Ca 0.06 -2.07 -0.12 0.00 0.00 0.00 0.00 46.02 43.89 1oyy n GLY 358 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1oyy h GLN 359 N 3.54 -0.40 -0.82 1.61 -0.00 -2.00 -2.59 115.11 114.45 1oyy h GLN 359 Ca 0.00 0.03 0.00 0.00 -0.00 0.00 0.00 58.65 58.68 1oyy h GLN 359 Cb 0.00 0.09 -0.04 0.00 0.00 0.00 0.00 27.48 27.53 1oyy h GLN 359 CO 0.00 -0.27 0.53 -0.07 0.00 0.00 0.00 178.83 179.02 1oyy h LEU 360 N -0.42 0.96 -0.42 -2.39 3.38 -1.91 -1.52 115.31 112.99 1oyy h LEU 360 Ca 0.05 -0.04 -0.16 0.00 0.09 0.00 0.00 57.88 57.83 1oyy h LEU 360 Cb 0.48 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1oyy h LEU 360 CO -0.20 0.71 -0.38 -0.61 0.09 0.00 0.00 178.44 178.06 1oyy h GLN 361 N 1.12 0.91 -0.03 1.13 4.15 -1.75 -1.70 115.11 118.95 1oyy h GLN 361 Ca 0.30 -0.47 0.03 0.00 0.77 0.00 0.00 58.65 59.27 1oyy h GLN 361 Cb -0.10 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.57 1oyy h GLN 361 CO -0.06 1.13 -0.15 -0.44 -1.93 0.00 0.00 178.83 177.38 1oyy h ASP 362 N 0.75 -0.43 -0.78 -0.69 3.32 -1.21 1.09 116.42 118.47 1oyy h ASP 362 Ca 0.06 0.07 0.04 0.00 0.02 0.00 0.00 57.03 57.22 1oyy h ASP 362 Cb 0.96 0.19 -0.05 0.00 0.22 0.00 0.00 39.33 40.65 1oyy h ASP 362 CO 0.09 -0.20 0.49 0.40 -1.72 0.00 0.00 179.24 178.30 1oyy h ILE 363 N -0.23 1.09 -0.42 0.35 2.04 -1.20 0.43 117.51 119.57 1oyy h ILE 363 Ca 0.06 -0.32 -0.09 0.00 1.00 0.00 0.00 64.86 65.51 1oyy h ILE 363 Cb 0.31 0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.44 1oyy h ILE 363 CO -0.17 0.17 -0.10 -0.08 0.00 0.00 0.00 178.15 177.98 1oyy h GLU 364 N 0.93 0.73 -0.03 2.37 4.81 -0.85 -2.52 114.58 120.02 1oyy h GLU 364 Ca 0.32 -0.23 -0.24 0.00 -0.13 0.00 0.00 59.36 59.08 1oyy h GLU 364 Cb 0.06 -0.07 0.02 0.00 0.63 0.00 0.00 28.75 29.39 1oyy h GLU 364 CO -0.13 0.81 -0.92 -0.09 -0.73 0.00 0.00 179.01 177.95 1oyy h ARG 365 N 0.67 0.68 -0.24 1.92 2.43 0.55 -2.12 114.38 118.26 1oyy h ARG 365 Ca 0.12 -0.69 0.05 0.00 -0.81 0.00 0.00 59.98 58.65 1oyy h ARG 365 Cb 0.55 0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 30.24 1oyy h ARG 365 CO 0.03 1.28 -0.07 1.25 -1.51 0.00 0.00 179.97 180.95 1oyy h HIS 366 N 0.35 -0.15 -0.09 2.20 2.76 -0.77 0.76 115.15 120.21 1oyy h HIS 366 Ca -0.11 0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 58.01 1oyy h HIS 366 Cb 1.57 0.10 -0.01 0.00 1.55 0.00 0.00 27.41 30.63 1oyy h HIS 366 CO 0.11 -0.11 -0.29 0.87 -1.30 0.00 0.00 177.93 177.21 1oyy h LYS 367 N -0.01 0.16 -0.13 5.26 1.57 -1.47 -0.60 116.57 121.35 1oyy h LYS 367 Ca 0.12 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.79 1oyy h LYS 367 Cb 0.19 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.49 1oyy h LYS 367 CO -0.25 0.44 -0.11 1.25 -0.57 0.00 0.00 179.45 180.20 1oyy h LEU 368 N 0.14 0.32 -1.11 2.94 5.85 -0.68 -1.76 115.31 121.02 1oyy h LEU 368 Ca 0.02 -0.47 -0.00 0.00 0.84 0.00 0.00 57.88 58.27 1oyy h LEU 368 Cb 0.58 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.48 1oyy h LEU 368 CO 0.04 0.72 0.53 0.78 -0.34 0.00 0.00 178.44 180.17 1oyy h ASN 369 N -0.07 1.00 0.87 1.25 2.35 -0.05 0.23 115.58 121.16 1oyy h ASN 369 Ca 0.02 -0.05 -0.08 0.00 -0.55 0.00 0.00 56.30 55.65 1oyy h ASN 369 Cb 0.62 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.73 1oyy h ASN 369 CO 0.03 0.75 -0.37 0.00 -1.65 0.00 0.00 177.43 176.19 1oyy h ALA 370 N 1.42 0.98 -0.27 -0.83 0.00 -0.67 0.42 119.26 120.32 1oyy h ALA 370 Ca 0.31 -0.34 -0.18 0.00 0.00 0.00 0.00 54.91 54.70 1oyy h ALA 370 Cb -0.08 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1oyy h ALA 370 CO -0.06 0.46 -0.53 1.98 0.00 0.00 0.00 179.25 181.10 1oyy h MET 371 N 0.00 0.83 -0.28 0.00 1.85 0.16 -1.47 114.93 116.01 1oyy h MET 371 Ca -0.00 -0.54 -0.09 0.00 -0.61 0.00 0.00 59.70 58.46 1oyy h MET 371 Cb 0.91 0.07 -0.01 0.00 0.43 0.00 0.00 31.60 32.99 1oyy h MET 371 CO 0.05 1.17 -0.21 0.78 -0.40 0.00 0.00 176.91 178.30 1oyy h GLY 372 N 0.59 0.57 1.87 1.39 0.00 0.08 -2.37 103.07 105.21 1oyy h GLY 372 Ca 0.01 -0.45 -0.07 0.00 0.00 0.00 0.00 47.33 46.83 1oyy h GLY 372 CO 0.12 0.41 -0.41 0.00 0.00 0.00 0.00 176.54 176.65 1oyy h ALA 373 N 1.31 0.78 -0.22 3.60 0.00 -0.61 -1.68 119.26 122.43 1oyy h ALA 373 Ca 0.07 -0.29 -0.14 0.00 0.00 0.00 0.00 54.91 54.55 1oyy h ALA 373 Cb 0.63 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1oyy h ALA 373 CO 0.04 0.38 -0.43 0.35 0.00 0.00 0.00 179.25 179.60 1oyy h PHE 374 N 0.00 0.86 -0.48 0.00 3.57 -0.79 -2.17 116.94 117.93 1oyy h PHE 374 Ca -0.01 -0.31 -0.07 0.00 3.53 0.00 0.00 57.97 61.11 1oyy h PHE 374 Cb 1.24 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.79 1oyy h PHE 374 CO 0.00 1.08 0.03 0.00 -2.23 0.00 0.00 178.31 177.19 1oyy h ALA 375 N 0.62 1.15 -0.51 2.41 0.00 -0.92 -2.39 119.26 119.61 1oyy h ALA 375 Ca 0.01 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 1oyy h ALA 375 Cb 1.03 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1oyy h ALA 375 CO 0.10 0.56 0.02 0.39 0.00 0.00 0.00 179.25 180.31 1oyy n GLU 376 N -4.23 4.29 -1.66 0.00 1.02 -0.69 -4.99 120.64 114.38 1oyy n GLU 376 Ca 0.03 -2.71 -0.38 0.00 -0.02 0.00 0.00 57.16 54.07 1oyy n GLU 376 Cb 0.28 -2.16 0.05 0.00 -0.02 0.00 0.00 31.44 29.59 1oyy n GLU 376 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1oyy n ALA 377 N 0.48 0.57 -0.64 0.62 0.00 -0.82 -4.92 120.51 115.81 1oyy n ALA 377 Ca 0.25 0.03 0.06 0.00 0.00 0.00 0.00 53.44 53.78 1oyy n ALA 377 Cb 1.09 -2.19 0.08 0.00 0.00 0.00 0.00 19.45 18.43 1oyy n ALA 377 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1oyy n GLN 378 N -1.13 1.97 -4.25 0.00 6.02 -1.26 -5.01 117.38 113.73 1oyy n GLN 378 Ca 0.13 -2.12 -0.19 0.00 -0.01 0.00 0.00 57.00 54.82 1oyy n GLN 378 Cb 0.47 -1.29 -0.11 0.00 1.02 0.00 0.00 30.24 30.33 1oyy n GLN 378 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1oyy s THR 379 N -2.08 1.38 -0.37 5.09 2.01 -1.26 -4.69 115.64 115.71 1oyy s THR 379 Ca 0.19 -1.70 -0.39 0.00 0.31 0.00 0.00 61.69 60.10 1oyy s THR 379 Cb 0.16 -1.53 -0.17 0.00 0.01 0.00 0.00 72.50 70.98 1oyy s THR 379 CO 0.02 -0.38 1.28 0.00 -0.69 0.00 0.00 174.62 174.85 1oyy h ARG 381 N 3.98 0.53 -0.35 0.00 2.47 -1.95 -1.05 114.38 118.01 1oyy h ARG 381 Ca -0.37 -0.03 -0.11 0.00 -1.26 0.00 0.00 59.98 58.20 1oyy h ARG 381 Cb 1.15 -0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 29.33 1oyy h ARG 381 CO 0.79 0.35 -0.25 -0.09 0.56 0.00 0.00 179.97 181.33 1oyy h ARG 382 N 0.55 0.70 -0.26 0.04 2.43 -1.95 -2.66 114.38 113.23 1oyy h ARG 382 Ca 0.17 -0.29 -0.11 0.00 -0.81 0.00 0.00 59.98 58.95 1oyy h ARG 382 Cb 0.03 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 1oyy h ARG 382 CO -0.04 0.88 -0.29 -0.07 -1.51 0.00 0.00 179.97 178.94 1oyy h LEU 383 N 0.61 0.54 0.30 3.80 3.38 -1.51 0.11 115.31 122.54 1oyy h LEU 383 Ca 0.08 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 1oyy h LEU 383 Cb 0.74 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 1oyy h LEU 383 CO 0.06 0.81 -0.27 0.58 0.09 0.00 0.00 178.44 179.71 1oyy h VAL 384 N 0.46 0.42 -0.52 1.22 2.07 -1.12 0.14 116.25 118.92 1oyy h VAL 384 Ca 0.06 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.58 1oyy h VAL 384 Cb 0.74 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 1oyy h VAL 384 CO 0.06 0.00 0.31 -0.07 0.02 0.00 0.00 177.57 177.89 1oyy h LEU 385 N -0.59 0.63 -0.57 2.57 3.38 -1.37 -1.73 115.31 117.62 1oyy h LEU 385 Ca -0.01 -0.06 -0.16 0.00 0.09 0.00 0.00 57.88 57.73 1oyy h LEU 385 Cb 0.54 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1oyy h LEU 385 CO -0.04 0.51 -0.64 -0.07 0.09 0.00 0.00 178.44 178.29 1oyy h LEU 386 N 0.70 0.32 0.00 1.67 -0.00 -0.26 -2.57 115.31 115.17 1oyy h LEU 386 Ca 0.19 -0.20 0.00 0.00 -0.00 0.00 0.00 57.88 57.87 1oyy h LEU 386 Cb 0.00 -0.09 0.00 0.00 -0.00 0.00 0.00 40.66 40.57 1oyy h LEU 386 CO -0.03 0.88 -0.26 0.59 -0.00 0.00 0.00 178.44 179.61 1oyy n ASN 387 N -3.85 0.43 0.06 -0.43 3.02 0.41 -1.28 115.26 113.62 1oyy n ASN 387 Ca -0.03 0.23 -0.13 0.00 -0.03 0.00 0.00 54.58 54.62 1oyy n ASN 387 Cb 0.65 -0.21 -0.04 0.00 -0.61 0.00 0.00 39.78 39.56 1oyy n ASN 387 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 1oyy h TYR 388 N 0.00 0.62 -0.00 3.10 3.20 -1.13 -1.01 116.97 121.75 1oyy h TYR 388 Ca 0.00 -0.33 0.00 0.00 3.14 0.00 0.00 58.73 61.54 1oyy h TYR 388 Cb 0.59 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.79 1oyy h TYR 388 CO 0.00 1.14 -0.00 1.19 -1.64 0.00 0.00 178.16 178.85 1oyy n PHE 389 N -3.76 0.00 -0.32 -3.82 3.72 -0.75 -4.71 117.46 107.81 1oyy n PHE 389 Ca -0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 1oyy n PHE 389 Cb 0.82 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 39.34 1oyy n PHE 389 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1oyy n GLY 390 N 1.04 0.74 3.25 1.37 0.00 -0.38 -4.03 105.19 107.18 1oyy n GLY 390 Ca 0.23 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.81 1oyy n GLY 390 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1oyy n GLU 391 N -2.14 3.67 -2.03 1.61 2.13 -0.40 -4.99 120.64 118.49 1oyy n GLU 391 Ca 0.00 -4.15 -0.43 0.00 0.66 0.00 0.00 57.16 53.24 1oyy n GLU 391 Cb 0.00 -2.75 -0.03 0.00 0.27 0.00 0.00 31.44 28.93 1oyy n GLU 391 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 1oyy s GLY 392 N 1.18 1.14 -0.04 8.31 0.00 -1.26 -4.03 107.32 112.62 1oyy s GLY 392 Ca 0.36 0.54 -0.05 0.00 0.00 0.00 0.00 44.72 45.57 1oyy s GLY 392 CO -0.01 3.13 0.13 -1.60 0.00 0.00 0.00 173.10 174.75 1oyy s ARG 393 N 4.90 0.21 -0.00 2.90 3.52 -1.26 -5.06 118.95 124.15 1oyy s ARG 393 Ca 0.76 0.06 0.03 0.00 -0.13 0.00 0.00 55.73 56.45 1oyy s ARG 393 Cb -0.27 0.10 -0.04 0.00 -1.56 0.00 0.00 34.95 33.18 1oyy s ARG 393 CO 0.31 -0.04 0.09 1.04 -0.81 0.00 0.00 175.30 175.89 1oyy n GLN 394 N 2.70 1.83 -2.33 5.12 3.00 -1.26 -4.51 117.38 121.93 1oyy n GLN 394 Ca -0.14 -0.02 -0.43 0.00 -0.01 0.00 0.00 57.00 56.40 1oyy n GLN 394 Cb 0.58 -0.95 -0.02 0.00 0.00 0.00 0.00 30.24 29.85 1oyy n GLN 394 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.06 175.06 1oyy s GLU 395 N -1.94 4.25 0.58 -1.09 2.12 -1.26 -5.01 118.70 116.35 1oyy s GLU 395 Ca -0.00 1.79 -0.19 0.00 0.36 0.00 0.00 54.97 56.92 1oyy s GLU 395 Cb 0.02 -3.75 -0.04 0.00 0.26 0.00 0.00 34.13 30.62 1oyy s GLU 395 CO 0.13 -0.68 1.22 -2.14 -0.54 0.00 0.00 175.26 173.24 1oyy s PRO 396 N 3.28 3.02 0.12 4.30 0.02 -1.26 -4.91 135.00 139.56 1oyy s PRO 396 Ca 0.59 1.85 -0.05 0.00 0.02 0.00 0.00 61.00 63.41 1oyy s PRO 396 Cb -0.25 -1.97 -0.14 0.00 0.02 0.00 0.00 34.50 32.16 1oyy s PRO 396 CO 0.20 -1.18 1.27 0.00 -0.33 0.00 0.00 177.00 176.96 1oyy n GLY 398 N 1.07 0.66 2.65 0.00 0.00 -1.26 -4.89 105.19 103.41 1oyy n GLY 398 Ca -0.07 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.86 1oyy n GLY 398 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1oyy n ASN 399 N -0.02 0.91 -3.96 1.61 5.15 -1.26 -4.72 115.26 112.96 1oyy n ASN 399 Ca 0.00 -2.69 -0.10 0.00 -0.60 0.00 0.00 54.58 51.20 1oyy n ASN 399 Cb 0.01 -0.29 -0.07 0.00 -0.53 0.00 0.00 39.78 38.90 1oyy n ASN 399 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1oyy h ASP 401 N 2.46 0.00 0.06 0.00 2.03 -1.41 -1.18 116.42 118.37 1oyy h ASP 401 Ca -0.31 0.00 -0.26 0.00 -0.73 0.00 0.00 57.03 55.73 1oyy h ASP 401 Cb 1.24 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 39.76 1oyy h ASP 401 CO 0.45 0.23 -1.03 0.40 -1.03 0.00 0.00 179.24 178.26 1oyy h ILE 402 N 0.00 1.30 -0.05 4.15 2.04 -1.88 -2.92 117.51 120.15 1oyy h ILE 402 Ca -0.00 -2.28 -0.13 0.00 1.00 0.00 0.00 64.86 63.45 1oyy h ILE 402 Cb 0.52 2.39 -0.01 0.00 -0.74 0.00 0.00 36.82 38.97 1oyy h ILE 402 CO 0.03 0.70 -0.54 0.00 0.00 0.00 0.00 178.15 178.34 1oyy h LEU 404 N 0.12 0.00 -5.60 0.00 3.38 -1.17 -3.34 115.31 108.70 1oyy h LEU 404 Ca -0.00 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.57 1oyy h LEU 404 Cb 1.00 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 41.45 1oyy h LEU 404 CO 0.08 0.01 -0.89 -0.67 0.09 0.00 0.00 178.44 177.06 1oyy n ASP 405 N -3.12 -0.65 -4.49 -0.43 -0.08 -0.81 -5.10 116.55 101.88 1oyy n ASP 405 Ca -0.01 -3.16 -0.44 0.00 -1.51 0.00 0.00 54.79 49.66 1oyy n ASP 405 Cb 0.21 0.37 -0.01 0.00 2.34 0.00 0.00 41.12 44.03 1oyy n ASP 405 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 1oyy n PRO 406 N 0.73 0.74 -2.48 -0.67 -0.02 0.08 -4.82 135.00 128.56 1oyy n PRO 406 Ca 0.17 0.26 -0.36 0.00 -2.02 0.00 0.00 63.50 61.56 1oyy n PRO 406 Cb 0.64 -1.51 -0.03 0.00 -0.02 0.00 0.00 33.50 32.58 1oyy n PRO 406 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1oyy s PRO 407 N -1.43 3.90 0.02 0.52 0.04 -1.26 -4.95 135.00 131.83 1oyy s PRO 407 Ca 0.62 1.50 -0.39 0.00 0.04 0.00 0.00 61.00 62.77 1oyy s PRO 407 Cb -0.72 -2.31 -0.19 0.00 0.04 0.00 0.00 34.50 31.32 1oyy s PRO 407 CO 0.58 -0.37 1.13 1.17 0.04 0.00 0.00 177.00 179.56 1oyy n LYS 408 N -0.57 0.25 -3.86 4.56 4.81 -1.26 -4.82 118.16 117.28 1oyy n LYS 408 Ca 0.07 0.09 -0.21 0.00 -0.87 0.00 0.00 58.31 57.40 1oyy n LYS 408 Cb 0.51 -1.62 -0.02 0.00 0.02 0.00 0.00 35.03 33.91 1oyy n LYS 408 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 1oyy s GLN 409 N 0.13 3.17 0.13 1.64 -1.52 -1.26 -0.44 119.66 121.51 1oyy s GLN 409 Ca 0.90 -0.95 -0.12 0.00 -1.95 0.00 0.00 55.36 53.24 1oyy s GLN 409 Cb -1.20 -2.76 0.01 0.00 -0.22 0.00 0.00 33.01 28.84 1oyy s GLN 409 CO 0.55 0.29 0.32 1.52 -0.25 0.00 0.00 175.29 177.73 1oyy s TYR 410 N -2.10 0.07 -0.34 0.91 1.13 -0.77 -4.73 117.35 111.52 1oyy s TYR 410 Ca 0.37 -0.44 -0.29 0.00 -1.41 0.00 0.00 57.07 55.31 1oyy s TYR 410 Cb -0.09 0.10 0.02 0.00 -1.10 0.00 0.00 41.96 40.90 1oyy s TYR 410 CO 0.28 -0.69 1.10 0.34 -2.51 0.00 0.00 175.55 174.07 1oyy s ASP 411 N -2.87 6.87 -0.03 -0.18 2.15 -1.26 -2.17 116.67 119.18 1oyy s ASP 411 Ca 0.08 0.96 0.19 0.00 0.43 0.00 0.00 52.55 54.21 1oyy s ASP 411 Cb 0.03 -2.54 0.60 0.00 -0.30 0.00 0.00 42.92 40.70 1oyy s ASP 411 CO -0.07 -0.95 1.50 0.61 -0.17 0.00 0.00 175.17 176.08 1oyy n GLY 412 N 4.05 2.16 0.27 2.66 0.00 0.34 -4.72 105.19 109.95 1oyy n GLY 412 Ca 0.12 -0.72 -0.06 0.00 0.00 0.00 0.00 46.02 45.36 1oyy n GLY 412 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1oyy h SER 413 N 3.75 -0.78 -0.58 1.61 0.02 -1.87 0.79 113.55 116.50 1oyy h SER 413 Ca 0.00 0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 61.11 1oyy h SER 413 Cb 1.02 0.40 -0.03 0.00 0.14 0.00 0.00 62.40 63.93 1oyy h SER 413 CO 0.07 -0.26 0.36 0.74 -1.14 0.00 0.00 176.83 176.60 1oyy h THR 414 N -0.17 1.17 -0.66 -2.27 2.02 -1.92 -1.77 112.91 109.30 1oyy h THR 414 Ca 0.19 -0.35 -0.01 0.00 0.77 0.00 0.00 66.41 67.00 1oyy h THR 414 Cb 0.46 0.36 -0.03 0.00 -1.74 0.00 0.00 68.15 67.20 1oyy h THR 414 CO -0.48 0.17 0.37 0.44 0.37 0.00 0.00 175.52 176.38 1oyy h ASP 415 N 0.78 0.82 -0.12 4.18 3.32 -1.32 -1.91 116.42 122.17 1oyy h ASP 415 Ca 0.21 -0.09 -0.09 0.00 0.02 0.00 0.00 57.03 57.08 1oyy h ASP 415 Cb -0.04 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.29 1oyy h ASP 415 CO -0.04 0.67 -0.20 0.00 -1.72 0.00 0.00 179.24 177.95 1oyy h ALA 416 N 1.18 1.13 -0.25 3.45 0.00 -0.75 -1.58 119.26 122.44 1oyy h ALA 416 Ca 0.23 -0.32 -0.18 0.00 0.00 0.00 0.00 54.91 54.64 1oyy h ALA 416 Cb 0.02 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1oyy h ALA 416 CO -0.04 0.55 -0.56 1.96 0.00 0.00 0.00 179.25 181.15 1oyy h GLN 417 N 0.47 0.77 -0.32 0.00 4.20 -0.56 0.25 115.11 119.93 1oyy h GLN 417 Ca 0.08 -0.50 0.06 0.00 0.06 0.00 0.00 58.65 58.35 1oyy h GLN 417 Cb 0.61 0.06 -0.06 0.00 0.30 0.00 0.00 27.48 28.39 1oyy h GLN 417 CO 0.04 1.13 -0.07 0.82 -0.67 0.00 0.00 178.83 180.08 1oyy h ILE 418 N 0.59 0.69 -0.21 2.54 2.04 -1.08 1.04 117.51 123.12 1oyy h ILE 418 Ca 0.01 -0.00 -0.19 0.00 1.00 0.00 0.00 64.86 65.67 1oyy h ILE 418 Cb 1.16 0.68 0.01 0.00 -0.74 0.00 0.00 36.82 37.92 1oyy h ILE 418 CO 0.12 0.00 -0.62 0.00 0.00 0.00 0.00 178.15 177.65 1oyy h ALA 419 N 1.31 0.36 -0.33 1.87 0.00 -0.75 -0.69 119.26 121.04 1oyy h ALA 419 Ca 0.15 -0.54 -0.13 0.00 0.00 0.00 0.00 54.91 54.39 1oyy h ALA 419 Cb 0.23 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1oyy h ALA 419 CO -0.32 0.63 -0.33 -0.07 0.00 0.00 0.00 179.25 179.16 1oyy h LEU 420 N 0.54 0.76 -0.54 0.00 3.38 -0.04 -2.17 115.31 117.25 1oyy h LEU 420 Ca -0.02 -0.32 -0.16 0.00 0.09 0.00 0.00 57.88 57.47 1oyy h LEU 420 Cb 1.25 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 1oyy h LEU 420 CO 0.13 1.03 -0.69 -1.28 0.09 0.00 0.00 178.44 177.73 1oyy h SER 421 N 0.62 0.25 0.12 -0.43 0.87 0.13 -1.84 113.55 113.28 1oyy h SER 421 Ca 0.07 -0.16 -0.01 0.00 -1.23 0.00 0.00 61.79 60.46 1oyy h SER 421 Cb 0.86 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.74 1oyy h SER 421 CO 0.07 0.86 -0.06 0.74 -0.53 0.00 0.00 176.83 177.92 1oyy h THR 422 N 0.15 1.02 -0.41 2.23 2.02 -0.55 0.22 112.91 117.59 1oyy h THR 422 Ca -0.02 -0.63 0.09 0.00 0.77 0.00 0.00 66.41 66.62 1oyy h THR 422 Cb 1.23 1.42 -0.09 0.00 -1.74 0.00 0.00 68.15 68.97 1oyy h THR 422 CO 0.11 0.15 -0.18 0.40 0.37 0.00 0.00 175.52 176.37 1oyy h ILE 423 N -0.47 0.45 -0.55 3.11 2.04 -1.36 0.36 117.51 121.09 1oyy h ILE 423 Ca -0.02 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.82 1oyy h ILE 423 Cb 0.37 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 1oyy h ILE 423 CO 0.03 0.00 0.25 1.23 0.00 0.00 0.00 178.15 179.66 1oyy h GLY 424 N -0.10 0.85 1.76 5.37 0.00 -1.14 -0.37 103.07 109.45 1oyy h GLY 424 Ca 0.20 -0.44 -0.03 0.00 0.00 0.00 0.00 47.33 47.06 1oyy h GLY 424 CO -0.47 0.41 -0.01 3.21 0.00 0.00 0.00 176.54 179.68 1oyy h ARG 425 N 0.74 0.30 -0.60 4.80 2.47 0.16 -0.03 114.38 122.22 1oyy h ARG 425 Ca 0.19 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.86 1oyy h ARG 425 Cb 0.14 -0.05 0.00 0.00 -1.65 0.00 0.00 29.97 28.41 1oyy h ARG 425 CO -0.02 0.34 0.00 1.33 0.56 0.00 0.00 179.97 182.18 1oyy n VAL 426 N -4.35 0.75 -1.90 2.04 0.24 0.11 -4.88 118.33 110.33 1oyy n VAL 426 Ca 0.00 -0.46 -0.13 0.00 -2.04 0.00 0.00 64.34 61.71 1oyy n VAL 426 Cb 0.20 -0.15 -0.02 0.00 -1.47 0.00 0.00 33.84 32.39 1oyy n VAL 426 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1oyy n ASN 427 N 0.27 -4.21 -2.41 -1.34 5.03 -0.02 -3.53 115.26 109.06 1oyy n ASN 427 Ca 0.10 0.11 -0.17 0.00 0.87 0.00 0.00 54.58 55.50 1oyy n ASN 427 Cb 0.45 -3.18 -0.01 0.00 -1.02 0.00 0.00 39.78 36.02 1oyy n ASN 427 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1oyy n GLN 428 N -2.38 -1.94 0.00 3.52 6.02 -0.15 -4.86 117.38 117.58 1oyy n GLN 428 Ca -0.14 0.81 0.11 0.00 -0.01 0.00 0.00 57.00 57.77 1oyy n GLN 428 Cb 0.54 -5.44 -0.01 0.00 1.02 0.00 0.00 30.24 26.34 1oyy n GLN 428 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1oyy n ARG 429 N -2.90 0.04 -4.79 -1.09 5.12 -1.23 -4.39 116.66 107.42 1oyy n ARG 429 Ca -0.20 -0.01 -0.31 0.00 -1.93 0.00 0.00 57.85 55.41 1oyy n ARG 429 Cb 0.65 -1.51 -0.13 0.00 -1.16 0.00 0.00 32.46 30.31 1oyy n ARG 429 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 1oyy s PHE 430 N -3.03 2.51 1.39 -1.55 0.40 -1.26 -4.77 117.98 111.67 1oyy s PHE 430 Ca 0.08 -0.29 -0.22 0.00 -0.60 0.00 0.00 56.93 55.90 1oyy s PHE 430 Cb 0.16 -1.47 0.35 0.00 0.51 0.00 0.00 43.02 42.57 1oyy s PHE 430 CO 0.82 0.20 0.97 0.20 0.70 0.00 0.00 175.22 178.11 1oyy s GLY 431 N -1.24 1.45 0.08 4.36 0.00 -1.26 -2.23 107.32 108.47 1oyy s GLY 431 Ca 0.13 -0.88 -0.22 0.00 0.00 0.00 0.00 44.72 43.75 1oyy s GLY 431 CO 0.04 0.12 1.64 1.98 0.00 0.00 0.00 173.10 176.87 1oyy h MET 432 N -3.28 0.11 -0.49 2.90 4.05 -1.95 -2.65 114.93 113.62 1oyy h MET 432 Ca -0.43 -0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 58.97 1oyy h MET 432 Cb 1.33 -0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 32.09 1oyy h MET 432 CO 0.28 0.19 0.28 0.78 0.23 0.00 0.00 176.91 178.67 1oyy h GLY 433 N -0.00 0.72 0.99 1.39 0.00 -1.99 -1.75 103.07 102.43 1oyy h GLY 433 Ca 0.03 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 1oyy h GLY 433 CO -0.00 0.30 0.34 -1.82 0.00 0.00 0.00 176.54 175.36 1oyy h TYR 434 N 0.65 0.78 -0.56 5.60 3.20 -1.90 0.52 116.97 125.26 1oyy h TYR 434 Ca 0.17 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.04 1oyy h TYR 434 Cb 0.02 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.01 1oyy h TYR 434 CO -0.02 0.55 0.35 0.28 -1.64 0.00 0.00 178.16 177.67 1oyy h VAL 435 N 0.79 1.16 -0.45 1.81 2.07 -1.11 -1.21 116.25 119.30 1oyy h VAL 435 Ca 0.21 -0.34 -0.07 0.00 0.82 0.00 0.00 66.70 67.32 1oyy h VAL 435 Cb 0.01 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.13 1oyy h VAL 435 CO -0.04 0.16 -0.01 0.58 0.02 0.00 0.00 177.57 178.28 1oyy h VAL 436 N 0.76 1.24 -0.41 2.57 2.07 -0.68 0.27 116.25 122.06 1oyy h VAL 436 Ca 0.20 -0.99 -0.03 0.00 0.82 0.00 0.00 66.70 66.70 1oyy h VAL 436 Cb -0.04 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 1oyy h VAL 436 CO -0.04 0.35 0.14 -0.33 0.02 0.00 0.00 177.57 177.71 1oyy h GLU 437 N 0.70 0.64 -0.41 1.57 4.39 -0.53 0.08 114.58 121.02 1oyy h GLU 437 Ca 0.14 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1oyy h GLU 437 Cb 0.45 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.98 1oyy h GLU 437 CO 0.02 0.62 0.26 0.28 -1.16 0.00 0.00 179.01 179.03 1oyy h VAL 438 N 0.52 1.12 -0.75 3.13 2.07 -0.41 0.23 116.25 122.16 1oyy h VAL 438 Ca 0.13 -0.25 0.02 0.00 0.82 0.00 0.00 66.70 67.43 1oyy h VAL 438 Cb 0.24 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 30.51 1oyy h VAL 438 CO -0.01 0.12 0.48 0.40 0.02 0.00 0.00 177.57 178.58 1oyy h ILE 439 N 0.55 1.13 -0.00 4.57 2.04 -0.16 -0.61 117.51 125.04 1oyy h ILE 439 Ca 0.15 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.68 1oyy h ILE 439 Cb -0.03 0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.14 1oyy h ILE 439 CO -0.03 0.17 -0.03 0.54 0.00 0.00 0.00 178.15 178.80 1oyy n ARG 440 N -4.61 0.97 -3.39 2.37 1.74 -0.01 -0.80 116.66 112.93 1oyy n ARG 440 Ca 0.08 -0.24 -0.19 0.00 -0.77 0.00 0.00 57.85 56.73 1oyy n ARG 440 Cb 0.07 -1.50 0.07 0.00 -1.02 0.00 0.00 32.46 30.08 1oyy n ARG 440 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1oyy n GLY 441 N 1.14 -0.31 3.61 -0.13 0.00 0.71 -4.22 105.19 106.00 1oyy n GLY 441 Ca 0.19 0.10 -0.31 0.00 0.00 0.00 0.00 46.02 46.00 1oyy n GLY 441 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oyy n ALA 442 N -4.42 -1.30 -3.15 4.61 0.00 -0.68 -4.85 120.51 110.72 1oyy n ALA 442 Ca -0.05 -0.61 -0.45 0.00 0.00 0.00 0.00 53.44 52.32 1oyy n ALA 442 Cb 0.57 -2.11 -0.02 0.00 0.00 0.00 0.00 19.45 17.90 1oyy n ALA 442 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1oyy s ASN 443 N -2.50 6.83 -0.11 0.00 0.01 -1.26 -4.96 114.94 112.94 1oyy s ASN 443 Ca 0.65 -2.63 0.02 0.00 -0.71 0.00 0.00 52.86 50.19 1oyy s ASN 443 Cb -0.23 -2.30 0.01 0.00 0.41 0.00 0.00 41.25 39.15 1oyy s ASN 443 CO 0.60 -0.72 -0.16 0.21 -1.51 0.00 0.00 177.10 175.52 1oyy s ASN 444 N 2.62 2.48 0.15 -1.22 3.84 -1.26 -5.03 114.94 116.52 1oyy s ASN 444 Ca 0.27 -0.44 -0.18 0.00 0.21 0.00 0.00 52.86 52.73 1oyy s ASN 444 Cb -0.07 -1.12 0.06 0.00 -0.55 0.00 0.00 41.25 39.57 1oyy s ASN 444 CO -0.08 0.03 1.68 -0.61 -2.79 0.00 0.00 177.10 175.33 1oyy h GLN 445 N 7.32 0.01 -0.38 0.43 5.75 -1.99 -1.65 115.11 124.60 1oyy h GLN 445 Ca -0.30 -0.00 0.08 0.00 -0.15 0.00 0.00 58.65 58.28 1oyy h GLN 445 Cb 1.18 -0.00 -0.09 0.00 1.07 0.00 0.00 27.48 29.64 1oyy h GLN 445 CO 0.49 0.01 -0.27 -0.09 -2.65 0.00 0.00 178.83 176.32 1oyy h ARG 446 N 0.01 -0.20 -0.81 1.69 2.43 -1.98 1.30 114.38 116.83 1oyy h ARG 446 Ca 0.16 0.01 0.12 0.00 -0.81 0.00 0.00 59.98 59.47 1oyy h ARG 446 Cb 0.24 0.05 -0.08 0.00 -0.42 0.00 0.00 29.97 29.75 1oyy h ARG 446 CO -0.34 -0.13 0.42 0.82 -1.51 0.00 0.00 179.97 179.24 1oyy h ILE 447 N -0.21 0.80 -0.34 1.20 2.04 -1.81 0.12 117.51 119.30 1oyy h ILE 447 Ca 0.18 -0.23 -0.17 0.00 1.00 0.00 0.00 64.86 65.64 1oyy h ILE 447 Cb 0.49 0.08 -0.00 0.00 -0.74 0.00 0.00 36.82 36.65 1oyy h ILE 447 CO -0.50 0.12 -0.46 0.03 0.00 0.00 0.00 178.15 177.34 1oyy h ARG 448 N 0.66 0.91 -0.86 2.37 3.08 -0.02 0.17 114.38 120.69 1oyy h ARG 448 Ca 0.42 -0.52 0.04 0.00 0.07 0.00 0.00 59.98 60.00 1oyy h ARG 448 Cb 0.52 0.04 -0.06 0.00 0.08 0.00 0.00 29.97 30.55 1oyy h ARG 448 CO -0.32 1.17 0.55 -0.44 -1.07 0.00 0.00 179.97 179.86 1oyy h ASP 449 N 0.72 0.89 -0.02 7.04 3.32 0.40 0.84 116.42 129.61 1oyy h ASP 449 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1oyy h ASP 449 Cb 1.06 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.42 1oyy h ASP 449 CO 0.11 0.60 0.00 -1.22 -1.72 0.00 0.00 179.24 177.00 1oyy n TYR 450 N -4.57 0.02 -1.68 4.55 4.01 -0.02 -4.90 117.16 114.57 1oyy n TYR 450 Ca 0.11 -0.01 -0.10 0.00 -0.16 0.00 0.00 57.90 57.74 1oyy n TYR 450 Cb 0.12 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.12 1oyy n TYR 450 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1oyy n GLY 451 N 1.06 0.66 0.10 2.72 0.00 0.29 -4.89 105.19 105.12 1oyy n GLY 451 Ca 0.20 -0.51 0.12 0.00 0.00 0.00 0.00 46.02 45.84 1oyy n GLY 451 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1oyy h HIS 452 N 0.00 0.00 0.00 1.61 3.86 -0.93 -2.42 115.15 117.28 1oyy h HIS 452 Ca -0.23 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 58.97 1oyy h HIS 452 Cb 0.89 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.36 1oyy h HIS 452 CO 0.29 0.00 -0.05 0.38 0.86 0.00 0.00 177.93 179.40 1oyy h ASP 453 N 0.00 0.00 1.86 2.45 2.03 -1.89 0.02 116.42 120.89 1oyy h ASP 453 Ca 0.00 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 56.29 1oyy h ASP 453 Cb 0.77 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.27 1oyy h ASP 453 CO 0.00 0.05 -0.07 0.11 -1.03 0.00 0.00 179.24 178.31 1oyy h LYS 454 N 0.00 0.00 -7.22 4.15 1.79 -1.76 -3.47 116.57 110.06 1oyy h LYS 454 Ca -0.00 0.00 -0.52 0.00 -2.18 0.00 0.00 60.65 57.95 1oyy h LYS 454 Cb 0.33 0.00 0.13 0.00 -1.58 0.00 0.00 32.23 31.11 1oyy h LYS 454 CO 0.01 0.07 0.36 -0.51 -1.08 0.00 0.00 179.45 178.29 1oyy s LEU 455 N -6.25 3.27 0.49 2.94 1.43 -0.01 -4.95 118.68 115.60 1oyy s LEU 455 Ca 0.06 2.09 0.28 0.00 -1.03 0.00 0.00 54.13 55.53 1oyy s LEU 455 Cb 0.06 -4.56 1.05 0.00 0.03 0.00 0.00 46.19 42.77 1oyy s LEU 455 CO 0.67 -1.99 1.87 0.50 0.23 0.00 0.00 176.35 177.63 1oyy h LYS 456 N -0.39 0.00 0.00 1.70 3.64 -1.90 -2.52 116.57 117.11 1oyy h LYS 456 Ca -0.46 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 58.82 1oyy h LYS 456 Cb 1.26 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.07 1oyy h LYS 456 CO 0.51 0.12 -0.47 -0.39 -2.27 0.00 0.00 179.45 176.95 1oyy h VAL 457 N 0.00 0.93 -1.82 2.00 -1.51 -1.92 -3.43 116.25 110.49 1oyy h VAL 457 Ca -0.00 -1.93 -0.62 0.00 -1.23 0.00 0.00 66.70 62.92 1oyy h VAL 457 Cb 0.67 2.19 0.01 0.00 -2.13 0.00 0.00 31.29 32.03 1oyy h VAL 457 CO 0.02 0.46 1.29 0.00 -1.23 0.00 0.00 177.57 178.10 1oyy n TYR 458 N -3.39 2.08 -1.00 5.19 9.36 -0.95 -1.06 117.16 127.40 1oyy n TYR 458 Ca 0.01 -0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.23 1oyy n TYR 458 Cb 0.63 -2.66 0.00 0.00 -0.63 0.00 0.00 39.34 36.68 1oyy n TYR 458 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1oyy n GLY 459 N 5.26 0.62 0.30 2.98 0.00 -0.37 -4.75 105.19 109.23 1oyy n GLY 459 Ca 0.29 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.48 1oyy n GLY 459 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1oyy h MET 460 N 1.52 0.00 -0.48 1.61 2.86 -0.83 -2.11 114.93 117.50 1oyy h MET 460 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1oyy h MET 460 Cb 0.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.68 1oyy h MET 460 CO 0.00 0.04 0.00 0.41 1.06 0.00 0.00 176.91 178.42 1oyy n GLY 461 N -0.67 2.91 0.31 8.32 0.00 0.02 -4.77 105.19 111.31 1oyy n GLY 461 Ca -0.02 -0.67 0.12 0.00 0.00 0.00 0.00 46.02 45.46 1oyy n GLY 461 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1oyy h ARG 462 N 2.90 0.08 0.00 1.61 2.43 -1.43 -1.95 114.38 118.02 1oyy h ARG 462 Ca 0.00 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1oyy h ARG 462 Cb 1.06 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.59 1oyy h ARG 462 CO 0.09 0.05 0.00 -0.40 -1.51 0.00 0.00 179.97 178.20 1oyy n ASP 463 N -4.48 0.34 -4.80 -3.80 5.75 -1.26 -4.68 116.55 103.62 1oyy n ASP 463 Ca 0.03 0.55 -0.22 0.00 -0.01 0.00 0.00 54.79 55.13 1oyy n ASP 463 Cb 0.28 -0.63 -0.05 0.00 -1.03 0.00 0.00 41.12 39.69 1oyy n ASP 463 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1oyy s LYS 464 N -3.07 2.85 0.58 0.11 1.02 -0.73 -5.12 119.74 115.37 1oyy s LYS 464 Ca 0.10 -1.10 -0.07 0.00 0.02 0.00 0.00 55.97 54.93 1oyy s LYS 464 Cb 0.14 -2.52 -0.01 0.00 -0.52 0.00 0.00 37.83 34.92 1oyy s LYS 464 CO 0.48 0.40 0.90 -1.54 -0.92 0.00 0.00 175.35 174.68 1oyy s SER 465 N -3.82 5.84 0.26 2.83 1.04 -1.26 -4.92 113.70 113.67 1oyy s SER 465 Ca 0.33 0.90 -0.02 0.00 0.48 0.00 0.00 55.95 57.64 1oyy s SER 465 Cb -0.08 -1.97 0.49 0.00 0.10 0.00 0.00 66.02 64.56 1oyy s SER 465 CO 0.24 -0.93 1.77 -0.74 0.98 0.00 0.00 173.24 174.56 1oyy h HIS 466 N -0.13 0.74 -0.50 5.02 2.76 -1.95 0.77 115.15 121.86 1oyy h HIS 466 Ca -0.46 0.03 -0.08 0.00 -2.20 0.00 0.00 60.37 57.66 1oyy h HIS 466 Cb 1.23 -0.21 -0.02 0.00 1.55 0.00 0.00 27.41 29.97 1oyy h HIS 466 CO 0.53 0.20 -0.02 1.05 -1.30 0.00 0.00 177.93 178.38 1oyy h GLU 467 N 0.63 0.85 -0.15 5.26 4.11 -1.97 0.37 114.58 123.67 1oyy h GLU 467 Ca 0.44 -0.25 0.02 0.00 0.07 0.00 0.00 59.36 59.64 1oyy h GLU 467 Cb 0.58 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 1oyy h GLU 467 CO -0.34 0.87 0.03 1.25 0.07 0.00 0.00 179.01 180.89 1oyy h HIS 468 N 0.79 0.06 -0.50 2.06 2.76 -1.24 0.07 115.15 119.14 1oyy h HIS 468 Ca 0.15 0.01 -0.05 0.00 -2.20 0.00 0.00 60.37 58.28 1oyy h HIS 468 Cb 0.51 -0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.44 1oyy h HIS 468 CO 0.03 0.02 0.13 -1.49 -1.30 0.00 0.00 177.93 175.32 1oyy h TRP 469 N 0.10 0.83 -0.14 5.26 4.06 -1.02 -0.79 115.95 124.25 1oyy h TRP 469 Ca 0.07 -0.10 0.03 0.00 2.06 0.00 0.00 58.89 60.95 1oyy h TRP 469 Cb 0.06 -0.24 -0.03 0.00 -1.00 0.00 0.00 29.16 27.95 1oyy h TRP 469 CO -0.12 0.74 -0.03 0.28 -3.56 0.00 0.00 178.44 175.74 1oyy h VAL 470 N 0.69 0.87 -0.44 1.49 2.07 0.30 -2.62 116.25 118.60 1oyy h VAL 470 Ca 0.16 -0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.71 1oyy h VAL 470 Cb 0.32 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 1oyy h VAL 470 CO 0.00 0.00 0.24 -1.28 0.02 0.00 0.00 177.57 176.55 1oyy h SER 471 N 0.00 0.37 0.07 0.57 0.87 -0.66 -1.85 113.55 112.93 1oyy h SER 471 Ca 0.07 0.01 0.02 0.00 -1.23 0.00 0.00 61.79 60.66 1oyy h SER 471 Cb 0.10 -0.06 -0.05 0.00 -0.44 0.00 0.00 62.40 61.95 1oyy h SER 471 CO -0.14 0.26 -0.48 0.58 -0.53 0.00 0.00 176.83 176.52 1oyy h VAL 472 N 0.48 0.07 -0.76 2.23 2.07 -1.01 0.48 116.25 119.81 1oyy h VAL 472 Ca 0.19 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.70 1oyy h VAL 472 Cb 0.06 0.07 -0.04 0.00 -1.52 0.00 0.00 31.29 29.86 1oyy h VAL 472 CO -0.11 0.00 0.44 0.40 0.02 0.00 0.00 177.57 178.32 1oyy h ILE 473 N -0.68 1.22 -0.64 4.57 2.04 -1.47 -1.07 117.51 121.49 1oyy h ILE 473 Ca 0.02 -0.52 -0.01 0.00 1.00 0.00 0.00 64.86 65.36 1oyy h ILE 473 Cb 0.72 0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.95 1oyy h ILE 473 CO -0.30 0.24 0.37 -0.09 0.00 0.00 0.00 178.15 178.37 1oyy h ARG 474 N 1.05 0.87 -0.09 2.37 2.43 -0.41 0.18 114.38 120.79 1oyy h ARG 474 Ca 0.27 -0.08 -0.08 0.00 -0.81 0.00 0.00 59.98 59.29 1oyy h ARG 474 Cb -0.01 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.35 1oyy h ARG 474 CO -0.05 0.62 -0.29 1.96 -1.51 0.00 0.00 179.97 180.70 1oyy h GLN 475 N 0.89 0.16 -0.20 0.20 4.20 0.49 0.35 115.11 121.20 1oyy h GLN 475 Ca 0.23 -0.05 -0.13 0.00 0.06 0.00 0.00 58.65 58.76 1oyy h GLN 475 Cb -0.02 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.75 1oyy h GLN 475 CO -0.04 0.44 -0.39 -0.07 -0.67 0.00 0.00 178.83 178.10 1oyy h LEU 476 N 0.14 0.68 -0.13 1.46 3.38 0.33 0.82 115.31 122.00 1oyy h LEU 476 Ca 0.02 -0.55 -0.02 0.00 0.09 0.00 0.00 57.88 57.42 1oyy h LEU 476 Cb 0.59 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 1oyy h LEU 476 CO 0.04 1.11 -0.01 0.40 0.09 0.00 0.00 178.44 180.06 1oyy h ILE 477 N 0.29 1.27 -0.00 1.22 2.04 -0.37 -0.51 117.51 121.46 1oyy h ILE 477 Ca 0.01 -0.90 0.00 0.00 1.00 0.00 0.00 64.86 64.97 1oyy h ILE 477 Cb 0.99 1.61 -0.00 0.00 -0.74 0.00 0.00 36.82 38.68 1oyy h ILE 477 CO 0.09 0.26 0.01 0.45 0.00 0.00 0.00 178.15 178.96 1oyy h HIS 478 N -0.05 0.00 -0.01 1.37 3.86 0.03 -1.02 115.15 119.33 1oyy h HIS 478 Ca 0.04 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.25 1oyy h HIS 478 Cb 0.41 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.88 1oyy h HIS 478 CO 0.04 0.00 -0.45 1.28 0.86 0.00 0.00 177.93 179.66 1oyy n LEU 479 N -3.28 1.67 0.00 2.43 4.77 0.25 -3.88 117.00 118.96 1oyy n LEU 479 Ca -0.03 -0.59 0.00 0.00 -0.03 0.00 0.00 56.01 55.36 1oyy n LEU 479 Cb 0.08 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1oyy n LEU 479 CO 0.22 0.32 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 1oyy n GLY 480 N 1.40 0.70 0.03 -0.72 0.00 -0.39 -4.34 105.19 101.88 1oyy n GLY 480 Ca 0.10 -0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.20 1oyy n GLY 480 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1oyy n LEU 481 N 0.00 0.63 -3.80 0.99 4.32 -0.25 -4.54 117.00 114.35 1oyy n LEU 481 Ca 0.00 0.03 -0.13 0.00 -0.02 0.00 0.00 56.01 55.88 1oyy n LEU 481 Cb 0.00 -0.14 -0.15 0.00 -1.62 0.00 0.00 43.42 41.51 1oyy n LEU 481 CO 0.00 0.04 -0.31 -0.69 -1.22 0.00 0.00 177.39 175.21 1oyy s VAL 482 N -3.14 -0.03 0.23 4.08 1.01 -0.90 -3.01 120.40 118.64 1oyy s VAL 482 Ca 0.06 0.12 0.08 0.00 0.00 0.00 0.00 61.98 62.24 1oyy s VAL 482 Cb 0.15 -0.11 -0.04 0.00 0.00 0.00 0.00 36.38 36.37 1oyy s VAL 482 CO 0.76 0.05 0.05 0.42 0.00 0.00 0.00 175.10 176.39 1oyy s THR 483 N 0.66 3.83 -0.28 3.92 -4.23 0.19 -3.89 115.64 115.84 1oyy s THR 483 Ca -0.05 -1.61 -0.07 0.00 -1.18 0.00 0.00 61.69 58.77 1oyy s THR 483 Cb -0.07 -3.02 -0.01 0.00 1.34 0.00 0.00 72.50 70.75 1oyy s THR 483 CO -0.02 -0.28 0.09 -1.10 -0.54 0.00 0.00 174.62 172.76 1oyy s GLN 484 N -3.49 3.32 -0.40 3.99 -0.21 -1.26 0.98 119.66 122.59 1oyy s GLN 484 Ca 0.31 -0.71 -0.27 0.00 0.02 0.00 0.00 55.36 54.70 1oyy s GLN 484 Cb -0.08 -3.38 0.02 0.00 1.00 0.00 0.00 33.01 30.57 1oyy s GLN 484 CO 0.21 -0.35 1.03 1.21 -2.12 0.00 0.00 175.29 175.26 1oyy s ASN 485 N 1.56 6.70 0.26 5.90 3.84 0.11 -4.84 114.94 128.47 1oyy s ASN 485 Ca 0.04 0.60 0.00 0.00 0.21 0.00 0.00 52.86 53.71 1oyy s ASN 485 Cb -0.16 -2.51 0.34 0.00 -0.55 0.00 0.00 41.25 38.37 1oyy s ASN 485 CO 0.03 -1.01 1.70 -0.29 -2.79 0.00 0.00 177.10 174.75 1oyy h ILE 486 N 5.96 1.26 0.00 -5.21 2.10 -1.91 0.68 117.51 120.39 1oyy h ILE 486 Ca -0.23 -1.25 0.00 0.00 1.08 0.00 0.00 64.86 64.47 1oyy h ILE 486 Cb 1.07 1.25 0.00 0.00 -1.09 0.00 0.00 36.82 38.05 1oyy h ILE 486 CO 1.04 0.41 0.00 0.00 -1.08 0.00 0.00 178.15 178.52 1oyy n ALA 487 N -2.49 2.50 -2.31 0.18 0.00 -1.26 -3.42 120.51 113.72 1oyy n ALA 487 Ca 0.00 -0.16 -0.22 0.00 0.00 0.00 0.00 53.44 53.07 1oyy n ALA 487 Cb 0.40 -1.48 0.02 0.00 0.00 0.00 0.00 19.45 18.39 1oyy n ALA 487 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1oyy n GLN 488 N -1.17 3.19 -3.53 0.00 6.02 -0.74 -4.94 117.38 116.21 1oyy n GLN 488 Ca 0.17 -4.16 -0.24 0.00 -0.01 0.00 0.00 57.00 52.77 1oyy n GLN 488 Cb 0.18 -2.13 0.07 0.00 1.02 0.00 0.00 30.24 29.38 1oyy n GLN 488 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1oyy n HIS 489 N -0.57 -2.78 -1.89 1.08 8.25 -1.20 -2.54 115.22 115.57 1oyy n HIS 489 Ca 0.36 0.96 -0.17 0.00 -0.26 0.00 0.00 57.72 58.61 1oyy n HIS 489 Cb 0.83 -4.96 -0.04 0.00 1.12 0.00 0.00 29.99 26.94 1oyy n HIS 489 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1oyy n SER 490 N -2.93 -4.99 -4.70 0.41 7.64 0.23 -4.59 113.62 104.68 1oyy n SER 490 Ca -0.00 0.21 -0.43 0.00 1.01 0.00 0.00 58.87 59.65 1oyy n SER 490 Cb 0.57 -4.03 -0.02 0.00 -1.01 0.00 0.00 64.21 59.71 1oyy n SER 490 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1oyy n ALA 491 N -0.20 1.88 -2.27 -0.43 0.00 -1.05 -4.19 120.51 114.24 1oyy n ALA 491 Ca -0.18 0.40 -0.43 0.00 0.00 0.00 0.00 53.44 53.23 1oyy n ALA 491 Cb 0.60 -2.38 -0.02 0.00 0.00 0.00 0.00 19.45 17.64 1oyy n ALA 491 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1oyy s LEU 492 N 0.12 4.25 0.12 0.00 1.43 -0.95 0.08 118.68 123.73 1oyy s LEU 492 Ca 0.69 1.92 0.07 0.00 -1.03 0.00 0.00 54.13 55.78 1oyy s LEU 492 Cb -0.58 -3.54 -0.04 0.00 0.03 0.00 0.00 46.19 42.06 1oyy s LEU 492 CO 0.46 -0.80 -0.17 -1.10 0.23 0.00 0.00 176.35 174.96 1oyy s GLN 493 N 3.50 1.08 0.10 1.70 -0.21 0.28 -4.51 119.66 121.61 1oyy s GLN 493 Ca 0.62 -1.22 -0.17 0.00 0.02 0.00 0.00 55.36 54.60 1oyy s GLN 493 Cb -0.27 -1.13 -0.07 0.00 1.00 0.00 0.00 33.01 32.55 1oyy s GLN 493 CO 0.21 0.24 0.56 -0.51 -2.12 0.00 0.00 175.29 173.67 1oyy s LEU 494 N -2.26 4.45 0.55 2.90 1.43 -1.26 0.57 118.68 125.07 1oyy s LEU 494 Ca 0.08 1.20 0.04 0.00 -1.03 0.00 0.00 54.13 54.41 1oyy s LEU 494 Cb -0.07 -3.04 0.03 0.00 0.03 0.00 0.00 46.19 43.14 1oyy s LEU 494 CO 0.04 0.21 0.28 0.42 0.23 0.00 0.00 176.35 177.53 1oyy s THR 495 N -1.25 1.36 0.35 5.49 -4.23 -1.16 -4.79 115.64 111.41 1oyy s THR 495 Ca 0.32 -1.66 0.05 0.00 -1.18 0.00 0.00 61.69 59.22 1oyy s THR 495 Cb -0.18 -2.02 0.19 0.00 1.34 0.00 0.00 72.50 71.83 1oyy s THR 495 CO 0.19 0.00 1.92 -0.33 -0.54 0.00 0.00 174.62 175.86 1oyy h GLU 496 N 0.88 0.54 0.00 3.99 4.39 -1.91 -2.50 114.58 119.98 1oyy h GLU 496 Ca -0.39 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.22 1oyy h GLU 496 Cb 1.32 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 1oyy h GLU 496 CO 0.62 0.51 0.00 0.00 -1.16 0.00 0.00 179.01 178.98 1oyy h ALA 497 N 1.56 1.00 -0.30 3.43 0.00 -1.90 -2.30 119.26 120.75 1oyy h ALA 497 Ca 0.12 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 1oyy h ALA 497 Cb 0.23 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1oyy h ALA 497 CO -0.00 0.00 -0.06 0.00 0.00 0.00 0.00 179.25 179.19 1oyy h ALA 498 N 2.01 1.34 -0.70 0.00 0.00 -1.64 -3.39 119.26 116.88 1oyy h ALA 498 Ca 0.00 -0.22 0.06 0.00 0.00 0.00 0.00 54.91 54.75 1oyy h ALA 498 Cb 0.11 -0.14 -0.08 0.00 0.00 0.00 0.00 17.79 17.68 1oyy h ALA 498 CO 0.00 0.45 -0.41 -2.13 0.00 0.00 0.00 179.25 177.15 1oyy n ARG 499 N -4.25 -0.31 0.22 0.00 0.63 -0.87 -1.46 116.66 110.63 1oyy n ARG 499 Ca 0.01 1.13 0.07 0.00 -0.92 0.00 0.00 57.85 58.14 1oyy n ARG 499 Cb 0.27 -1.67 0.52 0.00 0.45 0.00 0.00 32.46 32.03 1oyy n ARG 499 CO 0.00 0.00 0.00 -1.00 -2.51 0.00 0.00 177.63 174.12 1oyy h PRO 500 N 0.00 0.00 0.05 -0.14 0.13 -1.83 0.14 132.00 130.35 1oyy h PRO 500 Ca 0.11 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 65.08 1oyy h PRO 500 Cb 0.29 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.43 1oyy h PRO 500 CO -0.66 0.24 -0.66 0.28 -0.23 0.00 0.00 178.00 176.97 1oyy h VAL 501 N 0.00 1.46 -0.49 1.56 2.07 -1.64 0.50 116.25 119.71 1oyy h VAL 501 Ca -0.00 -2.24 0.01 0.00 0.82 0.00 0.00 66.70 65.29 1oyy h VAL 501 Cb 0.50 2.82 -0.03 0.00 -1.52 0.00 0.00 31.29 33.06 1oyy h VAL 501 CO 0.03 0.64 0.33 0.25 0.02 0.00 0.00 177.57 178.84 1oyy h LEU 502 N -0.21 0.54 -0.01 2.57 5.85 -1.13 -0.14 115.31 122.77 1oyy h LEU 502 Ca -0.10 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.61 1oyy h LEU 502 Cb 1.42 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.32 1oyy h LEU 502 CO 0.13 0.38 0.00 0.03 -0.34 0.00 0.00 178.44 178.64 1oyy h ARG 503 N 0.63 0.00 0.00 1.25 3.08 -1.00 -3.47 114.38 114.87 1oyy h ARG 503 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.24 1oyy h ARG 503 Cb -0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.03 1oyy h ARG 503 CO -0.04 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.27 1oyy n GLY 504 N 1.26 0.77 0.23 0.04 0.00 -0.07 -4.90 105.19 102.51 1oyy n GLY 504 Ca 0.05 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.16 1oyy n GLY 504 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1oyy h GLU 505 N 2.81 0.00 -3.90 1.61 5.08 -1.17 -3.44 114.58 115.58 1oyy h GLU 505 Ca 0.00 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.18 1oyy h GLU 505 Cb 0.00 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 29.03 1oyy h GLU 505 CO 0.00 0.24 -0.69 -1.12 -1.00 0.00 0.00 179.01 176.44 1oyy s SER 506 N -6.34 0.18 0.64 1.42 0.01 -0.66 -5.00 113.70 103.95 1oyy s SER 506 Ca -0.01 -0.38 -0.08 0.00 1.31 0.00 0.00 55.95 56.79 1oyy s SER 506 Cb 0.12 0.09 0.01 0.00 0.21 0.00 0.00 66.02 66.45 1oyy s SER 506 CO 0.64 -0.24 0.99 -0.44 0.41 0.00 0.00 173.24 174.60 1oyy s SER 507 N -1.15 5.52 -0.11 2.44 0.01 -1.26 -4.34 113.70 114.81 1oyy s SER 507 Ca -0.13 0.90 -0.05 0.00 1.31 0.00 0.00 55.95 57.99 1oyy s SER 507 Cb -0.08 -1.80 0.05 0.00 0.21 0.00 0.00 66.02 64.40 1oyy s SER 507 CO -0.01 -1.19 0.24 -0.22 0.41 0.00 0.00 173.24 172.47 1oyy s LEU 508 N -5.16 0.23 -0.19 2.44 2.96 -1.26 -4.97 118.68 112.73 1oyy s LEU 508 Ca 0.56 0.52 -0.14 0.00 -0.22 0.00 0.00 54.13 54.85 1oyy s LEU 508 Cb -0.11 0.68 -0.04 0.00 0.50 0.00 0.00 46.19 47.22 1oyy s LEU 508 CO 0.48 -0.19 0.30 -1.10 -1.32 0.00 0.00 176.35 174.53 1oyy s GLN 509 N 1.59 4.19 0.27 1.98 -1.52 -1.26 0.13 119.66 125.03 1oyy s GLN 509 Ca -0.06 0.05 0.11 0.00 -1.95 0.00 0.00 55.36 53.51 1oyy s GLN 509 Cb -0.11 -3.49 -0.05 0.00 -0.22 0.00 0.00 33.01 29.14 1oyy s GLN 509 CO -0.08 0.09 -0.18 -0.51 -0.25 0.00 0.00 175.29 174.36 1oyy s LEU 510 N 0.92 2.59 0.30 2.90 1.43 -0.92 -4.83 118.68 121.06 1oyy s LEU 510 Ca 0.15 -1.04 -0.29 0.00 -1.03 0.00 0.00 54.13 51.93 1oyy s LEU 510 Cb -0.14 -1.00 -0.10 0.00 0.03 0.00 0.00 46.19 44.99 1oyy s LEU 510 CO 0.05 -0.02 1.24 0.00 0.23 0.00 0.00 176.35 177.85 1oyy s ALA 511 N -2.62 3.47 -0.01 4.21 0.00 -1.26 -1.84 121.76 123.71 1oyy s ALA 511 Ca 0.28 1.12 -0.30 0.00 0.00 0.00 0.00 51.96 53.06 1oyy s ALA 511 Cb -0.04 -3.43 -0.09 0.00 0.00 0.00 0.00 23.12 19.57 1oyy s ALA 511 CO 0.13 -0.47 2.00 0.28 0.00 0.00 0.00 175.76 177.70 1oyy n VAL 512 N 1.13 0.71 -1.65 0.00 0.31 0.42 -4.83 118.33 114.41 1oyy n VAL 512 Ca 0.00 -0.17 -0.45 0.00 -0.01 0.00 0.00 64.34 63.71 1oyy n VAL 512 Cb 0.43 -2.30 -0.03 0.00 -0.91 0.00 0.00 33.84 31.04 1oyy n VAL 512 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1oyy n PRO 513 N 7.58 1.85 -2.16 5.55 -0.02 -1.26 -4.90 135.00 141.65 1oyy n PRO 513 Ca 0.22 0.66 -0.41 0.00 -2.02 0.00 0.00 63.50 61.95 1oyy n PRO 513 Cb 0.40 -2.27 -0.02 0.00 -0.02 0.00 0.00 33.50 31.58 1oyy n PRO 513 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 1oyy s ARG 514 N -0.51 4.38 -0.46 -0.52 1.70 -1.26 -4.97 118.95 117.31 1oyy s ARG 514 Ca 0.68 2.16 -0.28 0.00 -0.47 0.00 0.00 55.73 57.82 1oyy s ARG 514 Cb -0.68 -3.10 0.01 0.00 -0.57 0.00 0.00 34.95 30.60 1oyy s ARG 514 CO 0.51 -0.17 1.41 0.42 -1.08 0.00 0.00 175.30 176.39 1oyy s ILE 515 N -0.89 3.87 0.00 4.99 1.01 -1.26 -4.94 121.20 123.98 1oyy s ILE 515 Ca 0.50 0.85 0.00 0.00 0.00 0.00 0.00 60.65 62.00 1oyy s ILE 515 Cb -0.39 -4.28 0.00 0.00 0.01 0.00 0.00 42.46 37.81 1oyy s ILE 515 CO 0.49 -0.88 0.09 1.33 0.00 0.00 0.00 174.94 175.97